1-[[2-[(4-methylphenyl)carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]carbonyl]piperidine-4-carboxamide

Systemtic Name: 1-[[2-[(4-methylphenyl)carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]carbonyl]piperidine-4-carboxamide Openeye Name: 1-[2-[(4-methylbenzoyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl]piperidine-4-carboxamide CAS Name: 1-[[2-[[(4-methylphenyl)-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]-oxomethyl]-4-piperidinecarboxamide IUPAC Name: 1-[2-[(4-methylbenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonyl]piperidine-4-carboxamide Traditional Name: 1-[2-(p-toluoylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carbonyl]isonipecotamide Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)N4CCC(CC4)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)N4CCC(CC4)C(=O)N

InChI

InChI=1S/C23H27N3O3S/c1-14-6-8-16(9-7-14)21(28)25-22-19(17-4-2-3-5-18(17)30-22)23(29)26-12-10-15(11-13-26)20(24)27/h6-9,15H,2-5,10-13H2,1H3,(H2,24,27)(H,25,28)