N-(3-methylphenyl)-2-[2-oxidanylidene-2-[[3-(piperidin-1-ylmethyl)phenyl]amino]ethyl]sulfanyl-ethanamide

Systemtic Name: N-(3-methylphenyl)-2-[2-oxidanylidene-2-[[3-(piperidin-1-ylmethyl)phenyl]amino]ethyl]sulfanyl-ethanamide Openeye Name: N-(m-tolyl)-2-[2-oxo-2-[3-(1-piperidylmethyl)anilino]ethyl]sulfanyl-acetamide CAS Name: N-(3-methylphenyl)-2-[[2-oxo-2-[3-(1-piperidinylmethyl)anilino]ethyl]thio]acetamide IUPAC Name: N-(3-methylphenyl)-2-[2-oxo-2-[3-(piperidin-1-ylmethyl)anilino]ethyl]sulfanylacetamide Traditional Name: 2-[[2-keto-2-[3-(piperidinomethyl)anilino]ethyl]thio]-N-(m-tolyl)acetamide Formula: C23H29N3O2S MolecularWeight: 411.56026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)CSCC(=O)NC2=CC=CC(=C2)CN3CCCCC3

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)CSCC(=O)NC2=CC=CC(=C2)CN3CCCCC3

InChI

InChI=1S/C23H29N3O2S/c1-18-7-5-9-20(13-18)24-22(27)16-29-17-23(28)25-21-10-6-8-19(14-21)15-26-11-3-2-4-12-26/h5-10,13-14H,2-4,11-12,15-17H2,1H3,(H,24,27)(H,25,28)