3-[[2-[(4-cyanophenyl)sulfonyl-methyl-amino]ethanoylamino]methyl]-N-methyl-benzamide

Systemtic Name: 3-[[2-[(4-cyanophenyl)sulfonyl-methyl-amino]ethanoylamino]methyl]-N-methyl-benzamide Openeye Name: 3-[[[2-[(4-cyanophenyl)sulfonyl-methyl-amino]acetyl]amino]methyl]-N-methyl-benzamide CAS Name: 3-[[[2-[(4-cyanophenyl)sulfonyl-methylamino]-1-oxoethyl]amino]methyl]-N-methylbenzamide IUPAC Name: 3-[[[2-[(4-cyanophenyl)sulfonyl-methylamino]acetyl]amino]methyl]-N-methylbenzamide Traditional Name: 3-[[[2-[(4-cyanophenyl)sulfonyl-methyl-amino]acetyl]amino]methyl]-N-methyl-benzamide Formula: C19H20N4O4S MolecularWeight: 400.4515

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=CC=C1)CNC(=O)CN(C)S(=O)(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CNC(=O)C1=CC(=CC=C1)CNC(=O)CN(C)S(=O)(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C19H20N4O4S/c1-21-19(25)16-5-3-4-15(10-16)12-22-18(24)13-23(2)28(26,27)17-8-6-14(11-20)7-9-17/h3-10H,12-13H2,1-2H3,(H,21,25)(H,22,24)