2-[(2-methylphenyl)-methylsulfonyl-amino]-N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]ethanamide

Systemtic Name: 2-[(2-methylphenyl)-methylsulfonyl-amino]-N-[4-(3-oxidanylidenepiperazin-1-yl)phenyl]ethanamide Openeye Name: 2-(2-methyl-N-methylsulfonyl-anilino)-N-[4-(3-oxopiperazin-1-yl)phenyl]acetamide CAS Name: 2-(2-methyl-N-methylsulfonylanilino)-N-[4-(3-oxo-1-piperazinyl)phenyl]acetamide IUPAC Name: 2-(2-methyl-N-methylsulfonylanilino)-N-[4-(3-oxopiperazin-1-yl)phenyl]acetamide Traditional Name: N-[4-(3-ketopiperazino)phenyl]-2-(N-mesyl-2-methyl-anilino)acetamide Formula: C20H24N4O4S MolecularWeight: 416.49396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(CC(=O)NC2=CC=C(C=C2)N3CCNC(=O)C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1N(CC(=O)NC2=CC=C(C=C2)N3CCNC(=O)C3)S(=O)(=O)C

InChI

InChI=1S/C20H24N4O4S/c1-15-5-3-4-6-18(15)24(29(2,27)28)14-20(26)22-16-7-9-17(10-8-16)23-12-11-21-19(25)13-23/h3-10H,11-14H2,1-2H3,(H,21,25)(H,22,26)