N-[4-[2-[(3-chlorophenyl)-methylsulfonyl-amino]ethanoylamino]phenyl]-3-methyl-butanamide

Systemtic Name: N-[4-[2-[(3-chlorophenyl)-methylsulfonyl-amino]ethanoylamino]phenyl]-3-methyl-butanamide Openeye Name: N-[4-[[2-(3-chloro-N-methylsulfonyl-anilino)acetyl]amino]phenyl]-3-methyl-butanamide CAS Name: N-[4-[[2-(3-chloro-N-methylsulfonylanilino)-1-oxoethyl]amino]phenyl]-3-methylbutanamide IUPAC Name: N-[4-[[2-(3-chloro-N-methylsulfonylanilino)acetyl]amino]phenyl]-3-methylbutanamide Traditional Name: N-[4-[[2-(3-chloro-N-mesyl-anilino)acetyl]amino]phenyl]-3-methyl-butyramide Formula: C20H24ClN3O4S MolecularWeight: 437.94026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)CN(C2=CC(=CC=C2)Cl)S(=O)(=O)C

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)CN(C2=CC(=CC=C2)Cl)S(=O)(=O)C

InChI

InChI=1S/C20H24ClN3O4S/c1-14(2)11-19(25)22-16-7-9-17(10-8-16)23-20(26)13-24(29(3,27)28)18-6-4-5-15(21)12-18/h4-10,12,14H,11,13H2,1-3H3,(H,22,25)(H,23,26)