propan-2-yl 4-[cyclopropyl-[[6-(4-methylsulfinylphenyl)pyridin-3-yl]methyl]amino]piperidine-1-carboxylate

Systemtic Name: propan-2-yl 4-[cyclopropyl-[[6-(4-methylsulfinylphenyl)pyridin-3-yl]methyl]amino]piperidine-1-carboxylate Openeye Name: isopropyl 4-[cyclopropyl-[[6-(4-methylsulfinylphenyl)-3-pyridyl]methyl]amino]piperidine-1-carboxylate CAS Name: 4-[cyclopropyl-[[6-(4-methylsulfinylphenyl)-3-pyridinyl]methyl]amino]-1-piperidinecarboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[cyclopropyl-[[6-(4-methylsulfinylphenyl)pyridin-3-yl]methyl]amino]piperidine-1-carboxylate Traditional Name: 4-[cyclopropyl-[[6-(4-methylsulfinylphenyl)-3-pyridyl]methyl]amino]piperidine-1-carboxylic acid isopropyl ester Formula: C25H33N3O3S MolecularWeight: 455.61282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)N1CCC(CC1)N(CC2=CN=C(C=C2)C3=CC=C(C=C3)S(=O)C)C4CC4

Isomeric SMILES

CC(C)OC(=O)N1CCC(CC1)N(CC2=CN=C(C=C2)C3=CC=C(C=C3)S(=O)C)C4CC4

InChI

InChI=1S/C25H33N3O3S/c1-18(2)31-25(29)27-14-12-22(13-15-27)28(21-7-8-21)17-19-4-11-24(26-16-19)20-5-9-23(10-6-20)32(3)30/h4-6,9-11,16,18,21-22H,7-8,12-15,17H2,1-3H3