N-[1-(4-chlorophenyl)-2-methyl-propyl]-4-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[1-(4-chlorophenyl)-2-methyl-propyl]-4-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-[1-(4-chlorophenyl)-2-methyl-propyl]-4-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-[1-(4-chlorophenyl)-2-methylpropyl]-4-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-[1-(4-chlorophenyl)-2-methylpropyl]-4-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: N-[1-(4-chlorophenyl)-2-methyl-propyl]-4-(3-ketopiperazino)sulfonyl-benzamide Formula: C21H24ClN3O4S MolecularWeight: 449.95096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)Cl)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCNC(=O)C3

Isomeric SMILES

CC(C)C(C1=CC=C(C=C1)Cl)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCNC(=O)C3

InChI

InChI=1S/C21H24ClN3O4S/c1-14(2)20(15-3-7-17(22)8-4-15)24-21(27)16-5-9-18(10-6-16)30(28,29)25-12-11-23-19(26)13-25/h3-10,14,20H,11-13H2,1-2H3,(H,23,26)(H,24,27)