4-[[2-(8-chloranylnaphthalen-1-yl)sulfanylethanoyl-methyl-amino]methyl]-N-methyl-benzamide

Systemtic Name: 4-[[2-(8-chloranylnaphthalen-1-yl)sulfanylethanoyl-methyl-amino]methyl]-N-methyl-benzamide Openeye Name: 4-[[[2-[(8-chloro-1-naphthyl)sulfanyl]acetyl]-methyl-amino]methyl]-N-methyl-benzamide CAS Name: 4-[[[2-[(8-chloro-1-naphthalenyl)thio]-1-oxoethyl]-methylamino]methyl]-N-methylbenzamide IUPAC Name: 4-[[[2-(8-chloronaphthalen-1-yl)sulfanylacetyl]-methylamino]methyl]-N-methylbenzamide Traditional Name: 4-[[[2-[(8-chloro-1-naphthyl)thio]acetyl]-methyl-amino]methyl]-N-methyl-benzamide Formula: C22H21ClN2O2S MolecularWeight: 412.93234

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)CN(C)C(=O)CSC2=CC=CC3=C2C(=CC=C3)Cl

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)CN(C)C(=O)CSC2=CC=CC3=C2C(=CC=C3)Cl

InChI

InChI=1S/C22H21ClN2O2S/c1-24-22(27)17-11-9-15(10-12-17)13-25(2)20(26)14-28-19-8-4-6-16-5-3-7-18(23)21(16)19/h3-12H,13-14H2,1-2H3,(H,24,27)