2-[(3-methylphenyl)carbonylamino]-N-(pyridin-3-ylmethyl)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide

Systemtic Name: 2-[(3-methylphenyl)carbonylamino]-N-(pyridin-3-ylmethyl)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Openeye Name: 2-[(3-methylbenzoyl)amino]-N-(3-pyridylmethyl)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide CAS Name: 2-[[(3-methylphenyl)-oxomethyl]amino]-N-(3-pyridinylmethyl)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide IUPAC Name: 2-[(3-methylbenzoyl)amino]-N-(pyridin-3-ylmethyl)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Traditional Name: 2-(m-toluoylamino)-N-(3-pyridylmethyl)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=C(C3=C(S2)CCC3)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=C(C3=C(S2)CCC3)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C22H21N3O2S/c1-14-5-2-7-16(11-14)20(26)25-22-19(17-8-3-9-18(17)28-22)21(27)24-13-15-6-4-10-23-12-15/h2,4-7,10-12H,3,8-9,13H2,1H3,(H,24,27)(H,25,26)