N-(2,6-dimethylpiperidin-1-yl)-2-[2-[ethyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzamide

Systemtic Name: N-(2,6-dimethylpiperidin-1-yl)-2-[2-[ethyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzamide Openeye Name: 2-[2-[benzyl(ethyl)amino]-2-oxo-ethyl]sulfanyl-N-(2,6-dimethyl-1-piperidyl)benzamide CAS Name: N-(2,6-dimethyl-1-piperidinyl)-2-[[2-[ethyl-(phenylmethyl)amino]-2-oxoethyl]thio]benzamide IUPAC Name: 2-[2-[benzyl(ethyl)amino]-2-oxoethyl]sulfanyl-N-(2,6-dimethylpiperidin-1-yl)benzamide Traditional Name: 2-[[2-[benzyl(ethyl)amino]-2-keto-ethyl]thio]-N-(2,6-dimethylpiperidino)benzamide Formula: C25H33N3O2S MolecularWeight: 439.61342

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)CSC2=CC=CC=C2C(=O)NN3C(CCCC3C)C

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)CSC2=CC=CC=C2C(=O)NN3C(CCCC3C)C

InChI

InChI=1S/C25H33N3O2S/c1-4-27(17-21-13-6-5-7-14-21)24(29)18-31-23-16-9-8-15-22(23)25(30)26-28-19(2)11-10-12-20(28)3/h5-9,13-16,19-20H,4,10-12,17-18H2,1-3H3,(H,26,30)