[4-(2,3-dimethylphenyl)piperazin-1-yl]-[1-(1-methylimidazol-4-yl)sulfonylpiperidin-4-yl]methanone

Systemtic Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-[1-(1-methylimidazol-4-yl)sulfonylpiperidin-4-yl]methanone Openeye Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-[1-(1-methylimidazol-4-yl)sulfonyl-4-piperidyl]methanone CAS Name: [4-(2,3-dimethylphenyl)-1-piperazinyl]-[1-[(1-methyl-4-imidazolyl)sulfonyl]-4-piperidinyl]methanone IUPAC Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-[1-(1-methylimidazol-4-yl)sulfonylpiperidin-4-yl]methanone Traditional Name: [4-(2,3-dimethylphenyl)piperazino]-[1-(1-methylimidazol-4-yl)sulfonyl-4-piperidyl]methanone Formula: C22H31N5O3S MolecularWeight: 445.57824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CN(C=N4)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3CCN(CC3)S(=O)(=O)C4=CN(C=N4)C)C

InChI

InChI=1S/C22H31N5O3S/c1-17-5-4-6-20(18(17)2)25-11-13-26(14-12-25)22(28)19-7-9-27(10-8-19)31(29,30)21-15-24(3)16-23-21/h4-6,15-16,19H,7-14H2,1-3H3