1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-[methyl(thiophen-3-ylmethyl)amino]ethanone

Systemtic Name: 1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-[methyl(thiophen-3-ylmethyl)amino]ethanone Openeye Name: 1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-[methyl(3-thienylmethyl)amino]ethanone CAS Name: 1-[4-(3,4-dimethylphenyl)sulfonyl-1-piperazinyl]-2-[methyl(3-thiophenylmethyl)amino]ethanone IUPAC Name: 1-[4-(3,4-dimethylphenyl)sulfonylpiperazin-1-yl]-2-[methyl(thiophen-3-ylmethyl)amino]ethanone Traditional Name: 1-[4-(3,4-dimethylphenyl)sulfonylpiperazino]-2-[methyl(3-thenyl)amino]ethanone Formula: C20H27N3O3S2 MolecularWeight: 421.57668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN(C)CC3=CSC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CN(C)CC3=CSC=C3)C

InChI

InChI=1S/C20H27N3O3S2/c1-16-4-5-19(12-17(16)2)28(25,26)23-9-7-22(8-10-23)20(24)14-21(3)13-18-6-11-27-15-18/h4-6,11-12,15H,7-10,13-14H2,1-3H3