2-(3-nitrophenyl)-3-(4-phenylsulfanylphenyl)prop-2-enenitrile

Systemtic Name: 2-(3-nitrophenyl)-3-(4-phenylsulfanylphenyl)prop-2-enenitrile Openeye Name: 2-(3-nitrophenyl)-3-(4-phenylsulfanylphenyl)prop-2-enenitrile CAS Name: 2-(3-nitrophenyl)-3-[4-(phenylthio)phenyl]-2-propenenitrile IUPAC Name: 2-(3-nitrophenyl)-3-(4-phenylsulfanylphenyl)prop-2-enenitrile Traditional Name: 2-(3-nitrophenyl)-3-[4-(phenylthio)phenyl]acrylonitrile Formula: C21H14N2O2S MolecularWeight: 358.41306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=C(C=C2)C=C(C#N)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=C(C=C2)C=C(C#N)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H14N2O2S/c22-15-18(17-5-4-6-19(14-17)23(24)25)13-16-9-11-21(12-10-16)26-20-7-2-1-3-8-20/h1-14H