2-[2-[cyclopentyl-(2-methylphenyl)carbonyl-amino]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxamide

Systemtic Name: 2-[2-[cyclopentyl-(2-methylphenyl)carbonyl-amino]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxamide Openeye Name: 2-[[2-[cyclopentyl-(2-methylbenzoyl)amino]acetyl]amino]-4,5-dimethyl-thiophene-3-carboxamide CAS Name: 2-[[2-[cyclopentyl-[(2-methylphenyl)-oxomethyl]amino]-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxamide IUPAC Name: 2-[[2-[cyclopentyl-(2-methylbenzoyl)amino]acetyl]amino]-4,5-dimethylthiophene-3-carboxamide Traditional Name: 2-[[2-[cyclopentyl(o-toluoyl)amino]acetyl]amino]-4,5-dimethyl-thiophene-3-carboxamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N(CC(=O)NC2=C(C(=C(S2)C)C)C(=O)N)C3CCCC3

Isomeric SMILES

CC1=CC=CC=C1C(=O)N(CC(=O)NC2=C(C(=C(S2)C)C)C(=O)N)C3CCCC3

InChI

InChI=1S/C22H27N3O3S/c1-13-8-4-7-11-17(13)22(28)25(16-9-5-6-10-16)12-18(26)24-21-19(20(23)27)14(2)15(3)29-21/h4,7-8,11,16H,5-6,9-10,12H2,1-3H3,(H2,23,27)(H,24,26)