(2R)-N-(2-azanylethyl)-4-[cyclopropyl-[(5-methylthiophen-2-yl)methyl]amino]-1-pyridin-3-ylcarbonyl-piperidine-2-carboxamide

Systemtic Name: (2R)-N-(2-azanylethyl)-4-[cyclopropyl-[(5-methylthiophen-2-yl)methyl]amino]-1-pyridin-3-ylcarbonyl-piperidine-2-carboxamide Openeye Name: (2R)-N-(2-aminoethyl)-4-[cyclopropyl-[(5-methyl-2-thienyl)methyl]amino]-1-(pyridine-3-carbonyl)piperidine-2-carboxamide CAS Name: (2R)-N-(2-aminoethyl)-4-[cyclopropyl-[(5-methyl-2-thiophenyl)methyl]amino]-1-[oxo(3-pyridinyl)methyl]-2-piperidinecarboxamide IUPAC Name: (2R)-N-(2-aminoethyl)-4-[cyclopropyl-[(5-methylthiophen-2-yl)methyl]amino]-1-(pyridine-3-carbonyl)piperidine-2-carboxamide Traditional Name: (2R)-N-(2-aminoethyl)-4-[cyclopropyl-[(5-methyl-2-thienyl)methyl]amino]-1-nicotinoyl-pipecolinamide Formula: C23H31N5O2S MolecularWeight: 441.58954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CN(C2CC2)C3CCN(C(C3)C(=O)NCCN)C(=O)C4=CN=CC=C4

Isomeric SMILES

CC1=CC=C(S1)CN(C2CC2)C3CCN([C@H](C3)C(=O)NCCN)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C23H31N5O2S/c1-16-4-7-20(31-16)15-28(18-5-6-18)19-8-12-27(21(13-19)22(29)26-11-9-24)23(30)17-3-2-10-25-14-17/h2-4,7,10,14,18-19,21H,5-6,8-9,11-13,15,24H2,1H3,(H,26,29)/t19?,21-/m1/s1