(E)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(4-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(4-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(4-nitrophenyl)prop-2-enamide CAS Name: (E)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(4-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(4-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(4-nitrophenyl)acrylamide Formula: C18H15N3O3S MolecularWeight: 353.395

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C=CC3=CC=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)/C=C/C3=CC=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C18H15N3O3S/c19-11-15-14-3-1-2-4-16(14)25-18(15)20-17(22)10-7-12-5-8-13(9-6-12)21(23)24/h5-10H,1-4H2,(H,20,22)/b10-7+