(2R)-N-(2-azanylethyl)-1-ethanoyl-4-[(4-methoxyphenyl)methyl-(thiophen-2-ylmethyl)amino]piperidine-2-carboxamide

Systemtic Name: (2R)-N-(2-azanylethyl)-1-ethanoyl-4-[(4-methoxyphenyl)methyl-(thiophen-2-ylmethyl)amino]piperidine-2-carboxamide Openeye Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[(4-methoxyphenyl)methyl-(2-thienylmethyl)amino]piperidine-2-carboxamide CAS Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[(4-methoxyphenyl)methyl-(thiophen-2-ylmethyl)amino]-2-piperidinecarboxamide IUPAC Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[(4-methoxyphenyl)methyl-(thiophen-2-ylmethyl)amino]piperidine-2-carboxamide Traditional Name: (2R)-1-acetyl-N-(2-aminoethyl)-4-[p-anisyl(2-thenyl)amino]pipecolinamide Formula: C23H32N4O3S MolecularWeight: 444.59018

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC(CC1C(=O)NCCN)N(CC2=CC=C(C=C2)OC)CC3=CC=CS3

Isomeric SMILES

CC(=O)N1CCC(C[C@@H]1C(=O)NCCN)N(CC2=CC=C(C=C2)OC)CC3=CC=CS3

InChI

InChI=1S/C23H32N4O3S/c1-17(28)27-12-9-19(14-22(27)23(29)25-11-10-24)26(16-21-4-3-13-31-21)15-18-5-7-20(30-2)8-6-18/h3-8,13,19,22H,9-12,14-16,24H2,1-2H3,(H,25,29)/t19?,22-/m1/s1