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54118-07-9 | (5E)-3-ETHYL-5-(3-[(Z)-(3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE)METHYL]CYCLOHEX-2-EN-1-YLIDENE)-2-THIOXO-1,3-THIAZOLIDIN-4-ONE
CAS No: 54118-07-9 Catalog No: AG00DSLN MDL No:
Product Description
Catalog Number:
AG00DSLN
Chemical Name:
(5E)-3-ETHYL-5-(3-[(Z)-(3-ETHYL-1,3-BENZOTHIAZOL-2(3H)-YLIDENE)METHYL]CYCLOHEX-2-EN-1-YLIDENE)-2-THIOXO-1,3-THIAZOLIDIN-4-ONE
CAS Number:
54118-07-9
IUPAC Name:
3-ethyl-5-[3-[(3-ethyl-1,3-benzothiazol-2-ylidene)methyl]cyclohex-2-en-1-ylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
InChI:
InChI=1S/C21H22N2OS3/c1-3-22-16-10-5-6-11-17(16)26-18(22)13-14-8-7-9-15(12-14)19-20(24)23(4-2)21(25)27-19/h5-6,10-13H,3-4,7-9H2,1-2H3
InChI Key:
GNSUAPGTNIFLTB-UHFFFAOYSA-N
Properties
Complexity:
740
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
414.089g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
414.6g/mol
Monoisotopic Mass:
414.089g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
106A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2
XLogP3:
5.3
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