(E)-3-(4,5-dimethoxy-2-nitro-phenyl)-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(4,5-dimethoxy-2-nitro-phenyl)-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(4,5-dimethoxy-2-nitro-phenyl)-2-(4-phenylthiazol-2-yl)prop-2-enenitrile CAS Name: (E)-3-(4,5-dimethoxy-2-nitrophenyl)-2-(4-phenyl-2-thiazolyl)-2-propenenitrile IUPAC Name: (E)-3-(4,5-dimethoxy-2-nitrophenyl)-2-(4-phenyl-1,3-thiazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(4,5-dimethoxy-2-nitro-phenyl)-2-(4-phenylthiazol-2-yl)acrylonitrile Formula: C20H15N3O4S MolecularWeight: 393.4158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=C(C#N)C2=NC(=CS2)C3=CC=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)/C=C(\C#N)/C2=NC(=CS2)C3=CC=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C20H15N3O4S/c1-26-18-9-14(17(23(24)25)10-19(18)27-2)8-15(11-21)20-22-16(12-28-20)13-6-4-3-5-7-13/h3-10,12H,1-2H3/b15-8+