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

Systemtic Name: (2R)-N-(2-azanylethyl)-1-cyclopropylcarbonyl-4-[(4-methoxyphenyl)methyl-(thiophen-2-ylmethyl)amino]piperidine-2-carboxamide Openeye Name: (2R)-N-(2-aminoethyl)-1-(cyclopropanecarbonyl)-4-[(4-methoxyphenyl)methyl-(2-thienylmethyl)amino]piperidine-2-carboxamide CAS Name: (2R)-N-(2-aminoethyl)-1-[cyclopropyl(oxo)methyl]-4-[(4-methoxyphenyl)methyl-(thiophen-2-ylmethyl)amino]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(2-aminoethyl)-1-(cyclopropanecarbonyl)-4-[(4-methoxyphenyl)methyl-(thiophen-2-ylmethyl)amino]piperidine-2-carboxamide Traditional Name: (2R)-N-(2-aminoethyl)-1-(cyclopropanecarbonyl)-4-[p-anisyl(2-thenyl)amino]pipecolinamide Formula: C25H34N4O3S MolecularWeight: 470.62746

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN(CC2=CC=CS2)C3CCN(C(C3)C(=O)NCCN)C(=O)C4CC4

Isomeric SMILES

COC1=CC=C(C=C1)CN(CC2=CC=CS2)C3CCN([C@H](C3)C(=O)NCCN)C(=O)C4CC4

InChI

InChI=1S/C25H34N4O3S/c1-32-21-8-4-18(5-9-21)16-28(17-22-3-2-14-33-22)20-10-13-29(25(31)19-6-7-19)23(15-20)24(30)27-12-11-26/h2-5,8-9,14,19-20,23H,6-7,10-13,15-17,26H2,1H3,(H,27,30)/t20?,23-/m1/s1