2-[(E)-[(E)-3-cyano-4-phenyl-but-3-en-2-ylidene]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 2-[(E)-[(E)-3-cyano-4-phenyl-but-3-en-2-ylidene]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 2-[(E)-[(E)-2-cyano-1-methyl-3-phenyl-prop-2-enylidene]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 2-[(E)-[(E)-3-cyano-4-phenylbut-3-en-2-ylidene]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 2-[(E)-[(E)-3-cyano-4-phenylbut-3-en-2-ylidene]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-[(E)-[(E)-2-cyano-1-methyl-3-phenyl-prop-2-enylidene]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C20H19N3OS MolecularWeight: 349.44936

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NC1=C(C2=C(S1)CCCC2)C(=O)N)C(=CC3=CC=CC=C3)C#N

Isomeric SMILES

C/C(=N\C1=C(C2=C(S1)CCCC2)C(=O)N)/C(=C\C3=CC=CC=C3)/C#N

InChI

InChI=1S/C20H19N3OS/c1-13(15(12-21)11-14-7-3-2-4-8-14)23-20-18(19(22)24)16-9-5-6-10-17(16)25-20/h2-4,7-8,11H,5-6,9-10H2,1H3,(H2,22,24)/b15-11-,23-13+