(2R)-N-(2-azanylethyl)-4-[2-methylpropyl(oxolan-2-ylmethyl)amino]-1-thiophen-2-ylcarbonyl-piperidine-2-carboxamide

Systemtic Name: (2R)-N-(2-azanylethyl)-4-[2-methylpropyl(oxolan-2-ylmethyl)amino]-1-thiophen-2-ylcarbonyl-piperidine-2-carboxamide Openeye Name: (2R)-N-(2-aminoethyl)-4-[isobutyl(tetrahydrofuran-2-ylmethyl)amino]-1-(thiophene-2-carbonyl)piperidine-2-carboxamide CAS Name: (2R)-N-(2-aminoethyl)-4-[2-methylpropyl(2-oxolanylmethyl)amino]-1-[oxo(thiophen-2-yl)methyl]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(2-aminoethyl)-4-[2-methylpropyl(oxolan-2-ylmethyl)amino]-1-(thiophene-2-carbonyl)piperidine-2-carboxamide Traditional Name: (2R)-N-(2-aminoethyl)-4-[isobutyl(tetrahydrofurfuryl)amino]-1-(2-thenoyl)pipecolinamide Formula: C22H36N4O3S MolecularWeight: 436.61124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC1CCCO1)C2CCN(C(C2)C(=O)NCCN)C(=O)C3=CC=CS3

Isomeric SMILES

CC(C)CN(CC1CCCO1)C2CCN([C@H](C2)C(=O)NCCN)C(=O)C3=CC=CS3

InChI

InChI=1S/C22H36N4O3S/c1-16(2)14-25(15-18-5-3-11-29-18)17-7-10-26(22(28)20-6-4-12-30-20)19(13-17)21(27)24-9-8-23/h4,6,12,16-19H,3,5,7-11,13-15,23H2,1-2H3,(H,24,27)/t17?,18?,19-/m1/s1