N-[[1-[(3-methylphenyl)methyl]piperidin-4-yl]methyl]-4-oxidanylidene-2,3-dihydrothiochromene-8-carboxamide

Systemtic Name: N-[[1-[(3-methylphenyl)methyl]piperidin-4-yl]methyl]-4-oxidanylidene-2,3-dihydrothiochromene-8-carboxamide Openeye Name: N-[[1-(m-tolylmethyl)-4-piperidyl]methyl]-4-oxo-thiochromane-8-carboxamide CAS Name: N-[[1-[(3-methylphenyl)methyl]-4-piperidinyl]methyl]-4-oxo-2,3-dihydro-1-benzothiopyran-8-carboxamide IUPAC Name: N-[[1-[(3-methylphenyl)methyl]piperidin-4-yl]methyl]-4-oxo-2,3-dihydrothiochromene-8-carboxamide Traditional Name: 4-keto-N-[[1-(3-methylbenzyl)-4-piperidyl]methyl]thiochroman-8-carboxamide Formula: C24H28N2O2S MolecularWeight: 408.55632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCC(CC2)CNC(=O)C3=CC=CC4=C3SCCC4=O

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCC(CC2)CNC(=O)C3=CC=CC4=C3SCCC4=O

InChI

InChI=1S/C24H28N2O2S/c1-17-4-2-5-19(14-17)16-26-11-8-18(9-12-26)15-25-24(28)21-7-3-6-20-22(27)10-13-29-23(20)21/h2-7,14,18H,8-13,15-16H2,1H3,(H,25,28)