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15899-56-6 | Hydrazinecarbothioamide, 2-(2-oxo-1,2-diphenylethylidene)-
CAS No: 15899-56-6 Catalog No: AG001R34 MDL No:
Product Description
Catalog Number:
AG001R34
Chemical Name:
Hydrazinecarbothioamide, 2-(2-oxo-1,2-diphenylethylidene)-
CAS Number:
15899-56-6
Molecular Formula:
C15H13N3OS
Molecular Weight:
283.3482
IUPAC Name:
[[2-(6-oxocyclohexa-2,4-dien-1-yl)-2-phenylethylidene]amino]thiourea
InChI:
InChI=1S/C15H15N3OS/c16-15(20)18-17-10-13(11-6-2-1-3-7-11)12-8-4-5-9-14(12)19/h1-10,12-13H,(H3,16,18,20)
InChI Key:
RZPSRHSBKUVZIF-UHFFFAOYSA-N
SMILES:
NC(=S)NN=C(C(=O)c1ccccc1)c1ccccc1
Properties
Complexity:
450
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.094g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
285.365g/mol
Monoisotopic Mass:
285.094g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
99.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
1
XLogP3:
2
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