(Z)-3-(4-aminophenyl)sulfanyl-3-azanyl-2-[3-[oxidanyl(pyridin-4-yl)methyl]phenyl]prop-2-enenitrile

Systemtic Name: (Z)-3-(4-aminophenyl)sulfanyl-3-azanyl-2-[3-[oxidanyl(pyridin-4-yl)methyl]phenyl]prop-2-enenitrile Openeye Name: (Z)-3-amino-3-(4-aminophenyl)sulfanyl-2-[3-[hydroxy(4-pyridyl)methyl]phenyl]prop-2-enenitrile CAS Name: (Z)-3-amino-3-[(4-aminophenyl)thio]-2-[3-[hydroxy(pyridin-4-yl)methyl]phenyl]-2-propenenitrile IUPAC Name: (Z)-3-amino-3-(4-aminophenyl)sulfanyl-2-[3-[hydroxy(pyridin-4-yl)methyl]phenyl]prop-2-enenitrile Traditional Name: (Z)-3-amino-3-[(4-aminophenyl)thio]-2-[3-[hydroxy(4-pyridyl)methyl]phenyl]acrylonitrile Formula: C21H18N4OS MolecularWeight: 374.45882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(C2=CC=NC=C2)O)C(=C(N)SC3=CC=C(C=C3)N)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(C2=CC=NC=C2)O)/C(=C(\N)/SC3=CC=C(C=C3)N)/C#N

InChI

InChI=1S/C21H18N4OS/c22-13-19(21(24)27-18-6-4-17(23)5-7-18)15-2-1-3-16(12-15)20(26)14-8-10-25-11-9-14/h1-12,20,26H,23-24H2/b21-19+