(2R)-N-(2-azanylethyl)-4-[(4-methylphenyl)methyl-(2-methylpropyl)amino]-1-thiophen-2-ylcarbonyl-piperidine-2-carboxamide

Systemtic Name: (2R)-N-(2-azanylethyl)-4-[(4-methylphenyl)methyl-(2-methylpropyl)amino]-1-thiophen-2-ylcarbonyl-piperidine-2-carboxamide Openeye Name: (2R)-N-(2-aminoethyl)-4-[isobutyl(p-tolylmethyl)amino]-1-(thiophene-2-carbonyl)piperidine-2-carboxamide CAS Name: (2R)-N-(2-aminoethyl)-4-[(4-methylphenyl)methyl-(2-methylpropyl)amino]-1-[oxo(thiophen-2-yl)methyl]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(2-aminoethyl)-4-[(4-methylphenyl)methyl-(2-methylpropyl)amino]-1-(thiophene-2-carbonyl)piperidine-2-carboxamide Traditional Name: (2R)-N-(2-aminoethyl)-4-[isobutyl-(4-methylbenzyl)amino]-1-(2-thenoyl)pipecolinamide Formula: C25H36N4O2S MolecularWeight: 456.64394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(CC(C)C)C2CCN(C(C2)C(=O)NCCN)C(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)CN(CC(C)C)C2CCN([C@H](C2)C(=O)NCCN)C(=O)C3=CC=CS3

InChI

InChI=1S/C25H36N4O2S/c1-18(2)16-28(17-20-8-6-19(3)7-9-20)21-10-13-29(25(31)23-5-4-14-32-23)22(15-21)24(30)27-12-11-26/h4-9,14,18,21-22H,10-13,15-17,26H2,1-3H3,(H,27,30)/t21?,22-/m1/s1