5-methyl-2-(3-phenylprop-2-enoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: 5-methyl-2-(3-phenylprop-2-enoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: 5-methyl-2-(3-phenylprop-2-enoylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: 5-methyl-2-[(1-oxo-3-phenylprop-2-enyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: 5-methyl-2-(3-phenylprop-2-enoylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: 2-cinnamamido-5-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C19H20N2O2S MolecularWeight: 340.4393

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C(=C(S2)NC(=O)C=CC3=CC=CC=C3)C(=O)N

Isomeric SMILES

CC1CCC2=C(C1)C(=C(S2)NC(=O)C=CC3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C19H20N2O2S/c1-12-7-9-15-14(11-12)17(18(20)23)19(24-15)21-16(22)10-8-13-5-3-2-4-6-13/h2-6,8,10,12H,7,9,11H2,1H3,(H2,20,23)(H,21,22)