(2R)-N-(2-azanylethyl)-1-cyclopropylcarbonyl-4-[(5-methylthiophen-2-yl)methyl-(oxolan-2-ylmethyl)amino]piperidine-2-carboxamide

Systemtic Name: (2R)-N-(2-azanylethyl)-1-cyclopropylcarbonyl-4-[(5-methylthiophen-2-yl)methyl-(oxolan-2-ylmethyl)amino]piperidine-2-carboxamide Openeye Name: (2R)-N-(2-aminoethyl)-1-(cyclopropanecarbonyl)-4-[(5-methyl-2-thienyl)methyl-(tetrahydrofuran-2-ylmethyl)amino]piperidine-2-carboxamide CAS Name: (2R)-N-(2-aminoethyl)-1-[cyclopropyl(oxo)methyl]-4-[(5-methyl-2-thiophenyl)methyl-(2-oxolanylmethyl)amino]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(2-aminoethyl)-1-(cyclopropanecarbonyl)-4-[(5-methylthiophen-2-yl)methyl-(oxolan-2-ylmethyl)amino]piperidine-2-carboxamide Traditional Name: (2R)-N-(2-aminoethyl)-1-(cyclopropanecarbonyl)-4-[(5-methyl-2-thienyl)methyl-(tetrahydrofurfuryl)amino]pipecolinamide Formula: C23H36N4O3S MolecularWeight: 448.62194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CN(CC2CCCO2)C3CCN(C(C3)C(=O)NCCN)C(=O)C4CC4

Isomeric SMILES

CC1=CC=C(S1)CN(CC2CCCO2)C3CCN([C@H](C3)C(=O)NCCN)C(=O)C4CC4

InChI

InChI=1S/C23H36N4O3S/c1-16-4-7-20(31-16)15-26(14-19-3-2-12-30-19)18-8-11-27(23(29)17-5-6-17)21(13-18)22(28)25-10-9-24/h4,7,17-19,21H,2-3,5-6,8-15,24H2,1H3,(H,25,28)/t18?,19?,21-/m1/s1