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

Systemtic Name: (E)-2-(5-ethyl-4-phenyl-1,3-thiazol-2-yl)-3-(3-nitrophenyl)prop-2-enenitrile Openeye Name: (E)-2-(5-ethyl-4-phenyl-thiazol-2-yl)-3-(3-nitrophenyl)prop-2-enenitrile CAS Name: (E)-2-(5-ethyl-4-phenyl-2-thiazolyl)-3-(3-nitrophenyl)-2-propenenitrile IUPAC Name: (E)-2-(5-ethyl-4-phenyl-1,3-thiazol-2-yl)-3-(3-nitrophenyl)prop-2-enenitrile Traditional Name: (E)-2-(5-ethyl-4-phenyl-thiazol-2-yl)-3-(3-nitrophenyl)acrylonitrile Formula: C20H15N3O2S MolecularWeight: 361.417

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H15N3O2S/c1-2-18-19(15-8-4-3-5-9-15)22-20(26-18)16(13-21)11-14-7-6-10-17(12-14)23(24)25/h3-12H,2H2,1H3/b16-11+