[2-imidazo[1,2-a]pyridin-6-yl-2-(methylcarbamothioyl)cyclohexyl] pyrrolidine-2-carboxylate

Systemtic Name: [2-imidazo[1,2-a]pyridin-6-yl-2-(methylcarbamothioyl)cyclohexyl] pyrrolidine-2-carboxylate Openeye Name: [2-imidazo[1,2-a]pyridin-6-yl-2-(methylcarbamothioyl)cyclohexyl] pyrrolidine-2-carboxylate CAS Name: 2-pyrrolidinecarboxylic acid [2-(6-imidazo[1,2-a]pyridinyl)-2-[methylamino(sulfanylidene)methyl]cyclohexyl] ester IUPAC Name: [2-imidazo[1,2-a]pyridin-6-yl-2-(methylcarbamothioyl)cyclohexyl] pyrrolidine-2-carboxylate Traditional Name: pyrrolidine-2-carboxylic acid [2-imidazo[1,2-a]pyridin-6-yl-2-(methylthiocarbamoyl)cyclohexyl] ester Formula: C20H26N4O2S MolecularWeight: 386.51104

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)C1(CCCCC1OC(=O)C2CCCN2)C3=CN4C=CN=C4C=C3

Isomeric SMILES

CNC(=S)C1(CCCCC1OC(=O)C2CCCN2)C3=CN4C=CN=C4C=C3

InChI

InChI=1S/C20H26N4O2S/c1-21-19(27)20(14-7-8-17-23-11-12-24(17)13-14)9-3-2-6-16(20)26-18(25)15-5-4-10-22-15/h7-8,11-13,15-16,22H,2-6,9-10H2,1H3,(H,21,27)