(Z)-3-(2-aminophenyl)sulfanyl-3-azanyl-2-[3-[(3-nitrophenyl)-oxidanyl-methyl]phenyl]prop-2-enenitrile

Systemtic Name: (Z)-3-(2-aminophenyl)sulfanyl-3-azanyl-2-[3-[(3-nitrophenyl)-oxidanyl-methyl]phenyl]prop-2-enenitrile Openeye Name: (Z)-3-amino-3-(2-aminophenyl)sulfanyl-2-[3-[hydroxy-(3-nitrophenyl)methyl]phenyl]prop-2-enenitrile CAS Name: (Z)-3-amino-3-[(2-aminophenyl)thio]-2-[3-[hydroxy-(3-nitrophenyl)methyl]phenyl]-2-propenenitrile IUPAC Name: (Z)-3-amino-3-(2-aminophenyl)sulfanyl-2-[3-[hydroxy-(3-nitrophenyl)methyl]phenyl]prop-2-enenitrile Traditional Name: (Z)-3-amino-3-[(2-aminophenyl)thio]-2-[3-[hydroxy-(3-nitrophenyl)methyl]phenyl]acrylonitrile Formula: C22H18N4O3S MolecularWeight: 418.46832

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N)SC(=C(C#N)C2=CC(=CC=C2)C(C3=CC(=CC=C3)[N+](=O)[O-])O)N

Isomeric SMILES

C1=CC=C(C(=C1)N)S/C(=C(\C#N)/C2=CC(=CC=C2)C(C3=CC(=CC=C3)[N+](=O)[O-])O)/N

InChI

InChI=1S/C22H18N4O3S/c23-13-18(22(25)30-20-10-2-1-9-19(20)24)14-5-3-6-15(11-14)21(27)16-7-4-8-17(12-16)26(28)29/h1-12,21,27H,24-25H2/b22-18+