(Z)-3-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-3-(4-nitrophenyl)prop-2-enenitrile

Systemtic Name: (Z)-3-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-3-(4-nitrophenyl)prop-2-enenitrile Openeye Name: (Z)-3-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-3-(4-nitrophenyl)prop-2-enenitrile CAS Name: (Z)-3-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]-3-(4-nitrophenyl)-2-propenenitrile IUPAC Name: (Z)-3-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-3-(4-nitrophenyl)prop-2-enenitrile Traditional Name: (Z)-3-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]-3-(4-nitrophenyl)acrylonitrile Formula: C19H15N5O2S MolecularWeight: 377.4197

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(=CC#N)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CCN1C(=NN=C1S/C(=C\C#N)/C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C19H15N5O2S/c1-2-23-18(15-6-4-3-5-7-15)21-22-19(23)27-17(12-13-20)14-8-10-16(11-9-14)24(25)26/h3-12H,2H2,1H3/b17-12-