(Z)-3-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-(4-nitrophenyl)prop-2-enenitrile

Systemtic Name: (Z)-3-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-(4-nitrophenyl)prop-2-enenitrile Openeye Name: (Z)-3-(4-methylthiazol-2-yl)sulfanyl-3-(4-nitrophenyl)prop-2-enenitrile CAS Name: (Z)-3-[(4-methyl-2-thiazolyl)thio]-3-(4-nitrophenyl)-2-propenenitrile IUPAC Name: (Z)-3-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-(4-nitrophenyl)prop-2-enenitrile Traditional Name: (Z)-3-[(4-methylthiazol-2-yl)thio]-3-(4-nitrophenyl)acrylonitrile Formula: C13H9N3O2S2 MolecularWeight: 303.35946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SC(=CC#N)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CSC(=N1)S/C(=C\C#N)/C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H9N3O2S2/c1-9-8-19-13(15-9)20-12(6-7-14)10-2-4-11(5-3-10)16(17)18/h2-6,8H,1H3/b12-6-