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

Systemtic Name: (2R)-N-(2-azanylethyl)-4-[cyclohexylmethyl(phenethyl)amino]-1-cyclopropylcarbonyl-piperidine-2-carboxamide Openeye Name: (2R)-N-(2-aminoethyl)-4-[cyclohexylmethyl(phenethyl)amino]-1-(cyclopropanecarbonyl)piperidine-2-carboxamide CAS Name: (2R)-N-(2-aminoethyl)-4-[cyclohexylmethyl(phenethyl)amino]-1-[cyclopropyl(oxo)methyl]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(2-aminoethyl)-4-[cyclohexylmethyl(phenethyl)amino]-1-(cyclopropanecarbonyl)piperidine-2-carboxamide Traditional Name: (2R)-N-(2-aminoethyl)-4-[cyclohexylmethyl(phenethyl)amino]-1-(cyclopropanecarbonyl)pipecolinamide Formula: C27H42N4O2 MolecularWeight: 454.64798

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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)C4CC4

Isomeric SMILES

C1CCC(CC1)CN(CCC2=CC=CC=C2)C3CCN([C@H](C3)C(=O)NCCN)C(=O)C4CC4

InChI

InChI=1S/C27H42N4O2/c28-15-16-29-26(32)25-19-24(14-18-31(25)27(33)23-11-12-23)30(20-22-9-5-2-6-10-22)17-13-21-7-3-1-4-8-21/h1,3-4,7-8,22-25H,2,5-6,9-20,28H2,(H,29,32)/t24?,25-/m1/s1