N-(4-azanylcyclohexyl)-4-[2-methoxyethyl-[(2-methylphenyl)methyl]amino]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-4-[2-methoxyethyl-[(2-methylphenyl)methyl]amino]-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: N-(4-aminocyclohexyl)-4-[2-methoxyethyl(o-tolylmethyl)amino]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide CAS Name: N-(4-aminocyclohexyl)-4-[2-methoxyethyl-[(2-methylphenyl)methyl]amino]-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-4-[2-methoxyethyl-[(2-methylphenyl)methyl]amino]-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide Traditional Name: N-(4-aminocyclohexyl)-4-[2-methoxyethyl-(2-methylbenzyl)amino]-1-(2-thenoyl)pyrrolidine-2-carboxamide Formula: C27H38N4O3S MolecularWeight: 498.68062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN(CCOC)C2CC(N(C2)C(=O)C3=CC=CS3)C(=O)NC4CCC(CC4)N

Isomeric SMILES

CC1=CC=CC=C1CN(CCOC)C2CC(N(C2)C(=O)C3=CC=CS3)C(=O)NC4CCC(CC4)N

InChI

InChI=1S/C27H38N4O3S/c1-19-6-3-4-7-20(19)17-30(13-14-34-2)23-16-24(26(32)29-22-11-9-21(28)10-12-22)31(18-23)27(33)25-8-5-15-35-25/h3-8,15,21-24H,9-14,16-18,28H2,1-2H3,(H,29,32)