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Home > Imidazoles > 1193387-91-5
1193387-91-5 | N-phenyl-3-(2-sulfanylidene-2,3-dihydro-1H-imidazol-1-yl)benzamide
CAS No: 1193387-91-5 Catalog No: AG00HF0C MDL No:MFCD14703430
Product Description
Catalog Number:
AG00HF0C
Chemical Name:
N-phenyl-3-(2-sulfanylidene-2,3-dihydro-1H-imidazol-1-yl)benzamide
CAS Number:
1193387-91-5
Molecular Formula:
C16H13N3OS
Molecular Weight:
295.3589
MDL Number:
MFCD14703430
IUPAC Name:
N-phenyl-3-(2-sulfanylidene-1H-imidazol-3-yl)benzamide
InChI:
InChI=1S/C16H13N3OS/c20-15(18-13-6-2-1-3-7-13)12-5-4-8-14(11-12)19-10-9-17-16(19)21/h1-11H,(H,17,21)(H,18,20)
InChI Key:
YDVGVOCKHNAJPE-UHFFFAOYSA-N
SMILES:
O=C(c1cccc(c1)n1cc[nH]c1=S)Nc1ccccc1
Properties
Complexity:
431
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.078g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
295.36g/mol
Monoisotopic Mass:
295.078g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
76.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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