N-[1-(2,5-dimethylphenyl)ethyl]-3-(4-methylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[1-(2,5-dimethylphenyl)ethyl]-3-(4-methylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-[1-(2,5-dimethylphenyl)ethyl]-3-(4-methylpiperazin-1-yl)sulfonyl-benzamide CAS Name: N-[1-(2,5-dimethylphenyl)ethyl]-3-[(4-methyl-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-[1-(2,5-dimethylphenyl)ethyl]-3-(4-methylpiperazin-1-yl)sulfonylbenzamide Traditional Name: N-[1-(2,5-dimethylphenyl)ethyl]-3-(4-methylpiperazino)sulfonyl-benzamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(C)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(C)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCN(CC3)C

InChI

InChI=1S/C22H29N3O3S/c1-16-8-9-17(2)21(14-16)18(3)23-22(26)19-6-5-7-20(15-19)29(27,28)25-12-10-24(4)11-13-25/h5-9,14-15,18H,10-13H2,1-4H3,(H,23,26)