1-imidazo[1,2-a]pyridin-3-yl-N-methyl-2-[(phenylmethyl)amino]cyclohexane-1-carbothioamide

Systemtic Name: 1-imidazo[1,2-a]pyridin-3-yl-N-methyl-2-[(phenylmethyl)amino]cyclohexane-1-carbothioamide Openeye Name: 2-(benzylamino)-1-imidazo[1,2-a]pyridin-3-yl-N-methyl-cyclohexanecarbothioamide CAS Name: 1-(3-imidazo[1,2-a]pyridinyl)-N-methyl-2-[(phenylmethyl)amino]-1-cyclohexanecarbothioamide IUPAC Name: 2-(benzylamino)-1-imidazo[1,2-a]pyridin-3-yl-N-methylcyclohexane-1-carbothioamide Traditional Name: 2-(benzylamino)-1-imidazo[1,2-a]pyridin-3-yl-N-methyl-cyclohexanecarbothioamide Formula: C22H26N4S MolecularWeight: 378.53364

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)C1(CCCCC1NCC2=CC=CC=C2)C3=CN=C4N3C=CC=C4

Isomeric SMILES

CNC(=S)C1(CCCCC1NCC2=CC=CC=C2)C3=CN=C4N3C=CC=C4

InChI

InChI=1S/C22H26N4S/c1-23-21(27)22(19-16-25-20-12-6-8-14-26(19)20)13-7-5-11-18(22)24-15-17-9-3-2-4-10-17/h2-4,6,8-10,12,14,16,18,24H,5,7,11,13,15H2,1H3,(H,23,27)