[4-(2,3-dimethylphenyl)piperazin-1-yl]-(1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrol-2-yl)methanone

Systemtic Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrol-2-yl)methanone Openeye Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(1-methyl-4-pyrrolidin-1-ylsulfonyl-pyrrol-2-yl)methanone CAS Name: [4-(2,3-dimethylphenyl)-1-piperazinyl]-[1-methyl-4-(1-pyrrolidinylsulfonyl)-2-pyrrolyl]methanone IUPAC Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(1-methyl-4-pyrrolidin-1-ylsulfonylpyrrol-2-yl)methanone Traditional Name: [4-(2,3-dimethylphenyl)piperazino]-(1-methyl-4-pyrrolidinosulfonyl-pyrrol-2-yl)methanone Formula: C22H30N4O3S MolecularWeight: 430.5636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC(=CN3C)S(=O)(=O)N4CCCC4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC(=CN3C)S(=O)(=O)N4CCCC4)C

InChI

InChI=1S/C22H30N4O3S/c1-17-7-6-8-20(18(17)2)24-11-13-25(14-12-24)22(27)21-15-19(16-23(21)3)30(28,29)26-9-4-5-10-26/h6-8,15-16H,4-5,9-14H2,1-3H3