(Z)-2-azanyl-3-[[2-(4-chlorophenyl)sulfanylphenyl]methylamino]but-2-enedinitrile

Systemtic Name: (Z)-2-azanyl-3-[[2-(4-chlorophenyl)sulfanylphenyl]methylamino]but-2-enedinitrile Openeye Name: (Z)-2-amino-3-[[2-(4-chlorophenyl)sulfanylphenyl]methylamino]but-2-enedinitrile CAS Name: (Z)-2-amino-3-[[2-[(4-chlorophenyl)thio]phenyl]methylamino]-2-butenedinitrile IUPAC Name: (Z)-2-amino-3-[[2-(4-chlorophenyl)sulfanylphenyl]methylamino]but-2-enedinitrile Traditional Name: (Z)-2-amino-3-[[2-[(4-chlorophenyl)thio]benzyl]amino]but-2-enedinitrile Formula: C17H13ClN4S MolecularWeight: 340.82992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CNC(=C(C#N)N)C#N)SC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CN/C(=C(/C#N)\N)/C#N)SC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H13ClN4S/c18-13-5-7-14(8-6-13)23-17-4-2-1-3-12(17)11-22-16(10-20)15(21)9-19/h1-8,22H,11,21H2/b16-15-