N-[2-(1H-indol-3-yl)ethyl]-6-methyl-2-[1-(2-morpholin-4-ylethylcarbamothioyl)piperidin-4-yl]pyridine-3-carboxamide

Systemtic Name: N-[2-(1H-indol-3-yl)ethyl]-6-methyl-2-[1-(2-morpholin-4-ylethylcarbamothioyl)piperidin-4-yl]pyridine-3-carboxamide Openeye Name: N-[2-(1H-indol-3-yl)ethyl]-6-methyl-2-[1-(2-morpholinoethylcarbamothioyl)-4-piperidyl]pyridine-3-carboxamide CAS Name: N-[2-(1H-indol-3-yl)ethyl]-6-methyl-2-[1-[[2-(4-morpholinyl)ethylamino]-sulfanylidenemethyl]-4-piperidinyl]-3-pyridinecarboxamide IUPAC Name: N-[2-(1H-indol-3-yl)ethyl]-6-methyl-2-[1-(2-morpholin-4-ylethylcarbamothioyl)piperidin-4-yl]pyridine-3-carboxamide Traditional Name: N-[2-(1H-indol-3-yl)ethyl]-6-methyl-2-[1-(2-morpholinoethylthiocarbamoyl)-4-piperidyl]nicotinamide Formula: C29H38N6O2S MolecularWeight: 534.71602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C(=O)NCCC2=CNC3=CC=CC=C32)C4CCN(CC4)C(=S)NCCN5CCOCC5

Isomeric SMILES

CC1=NC(=C(C=C1)C(=O)NCCC2=CNC3=CC=CC=C32)C4CCN(CC4)C(=S)NCCN5CCOCC5

InChI

InChI=1S/C29H38N6O2S/c1-21-6-7-25(28(36)30-11-8-23-20-32-26-5-3-2-4-24(23)26)27(33-21)22-9-13-35(14-10-22)29(38)31-12-15-34-16-18-37-19-17-34/h2-7,20,22,32H,8-19H2,1H3,(H,30,36)(H,31,38)