(2R)-N-(2-azanylethyl)-4-[cyclohexylmethyl(phenethyl)amino]-1-thiophen-2-ylcarbonyl-piperidine-2-carboxamide

Systemtic Name: (2R)-N-(2-azanylethyl)-4-[cyclohexylmethyl(phenethyl)amino]-1-thiophen-2-ylcarbonyl-piperidine-2-carboxamide Openeye Name: (2R)-N-(2-aminoethyl)-4-[cyclohexylmethyl(phenethyl)amino]-1-(thiophene-2-carbonyl)piperidine-2-carboxamide CAS Name: (2R)-N-(2-aminoethyl)-4-[cyclohexylmethyl(phenethyl)amino]-1-[oxo(thiophen-2-yl)methyl]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(2-aminoethyl)-4-[cyclohexylmethyl(phenethyl)amino]-1-(thiophene-2-carbonyl)piperidine-2-carboxamide Traditional Name: (2R)-N-(2-aminoethyl)-4-[cyclohexylmethyl(phenethyl)amino]-1-(2-thenoyl)pipecolinamide Formula: C28H40N4O2S MolecularWeight: 496.7078

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN(CCC2=CC=CC=C2)C3CCN(C(C3)C(=O)NCCN)C(=O)C4=CC=CS4

Isomeric SMILES

C1CCC(CC1)CN(CCC2=CC=CC=C2)C3CCN([C@H](C3)C(=O)NCCN)C(=O)C4=CC=CS4

InChI

InChI=1S/C28H40N4O2S/c29-15-16-30-27(33)25-20-24(14-18-32(25)28(34)26-12-7-19-35-26)31(21-23-10-5-2-6-11-23)17-13-22-8-3-1-4-9-22/h1,3-4,7-9,12,19,23-25H,2,5-6,10-11,13-18,20-21,29H2,(H,30,33)/t24?,25-/m1/s1