3-(3-methylphenyl)-1-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: 3-(3-methylphenyl)-1-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: 1-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]-3-(m-tolyl)propan-1-one CAS Name: 3-(3-methylphenyl)-1-[4-[(4-methyl-1-piperazinyl)sulfonyl]-1-piperazinyl]-1-propanone IUPAC Name: 3-(3-methylphenyl)-1-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: 1-[4-(4-methylpiperazino)sulfonylpiperazino]-3-(m-tolyl)propan-1-one Formula: C19H30N4O3S MolecularWeight: 394.5315

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CCC(=O)N2CCN(CC2)S(=O)(=O)N3CCN(CC3)C

Isomeric SMILES

CC1=CC(=CC=C1)CCC(=O)N2CCN(CC2)S(=O)(=O)N3CCN(CC3)C

InChI

InChI=1S/C19H30N4O3S/c1-17-4-3-5-18(16-17)6-7-19(24)21-10-14-23(15-11-21)27(25,26)22-12-8-20(2)9-13-22/h3-5,16H,6-15H2,1-2H3