(E)-2-[5-ethyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-(4-nitrophenyl)prop-2-enenitrile

Systemtic Name: (E)-2-[5-ethyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-(4-nitrophenyl)prop-2-enenitrile Openeye Name: (E)-2-[5-ethyl-4-(p-tolyl)thiazol-2-yl]-3-(4-nitrophenyl)prop-2-enenitrile CAS Name: (E)-2-[5-ethyl-4-(4-methylphenyl)-2-thiazolyl]-3-(4-nitrophenyl)-2-propenenitrile IUPAC Name: (E)-2-[5-ethyl-4-(4-methylphenyl)-1,3-thiazol-2-yl]-3-(4-nitrophenyl)prop-2-enenitrile Traditional Name: (E)-2-[5-ethyl-4-(p-tolyl)thiazol-2-yl]-3-(4-nitrophenyl)acrylonitrile Formula: C21H17N3O2S MolecularWeight: 375.44358

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N=C(S1)C(=CC2=CC=C(C=C2)[N+](=O)[O-])C#N)C3=CC=C(C=C3)C

Isomeric SMILES

CCC1=C(N=C(S1)/C(=C/C2=CC=C(C=C2)[N+](=O)[O-])/C#N)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H17N3O2S/c1-3-19-20(16-8-4-14(2)5-9-16)23-21(27-19)17(13-22)12-15-6-10-18(11-7-15)24(25)26/h4-12H,3H2,1-2H3/b17-12+