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

Systemtic Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(1-methyl-4-morpholin-4-ylsulfonyl-pyrrol-2-yl)methanone Openeye Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(1-methyl-4-morpholinosulfonyl-pyrrol-2-yl)methanone CAS Name: [4-(2,3-dimethylphenyl)-1-piperazinyl]-[1-methyl-4-(4-morpholinylsulfonyl)-2-pyrrolyl]methanone IUPAC Name: [4-(2,3-dimethylphenyl)piperazin-1-yl]-(1-methyl-4-morpholin-4-ylsulfonylpyrrol-2-yl)methanone Traditional Name: [4-(2,3-dimethylphenyl)piperazino]-(1-methyl-4-morpholinosulfonyl-pyrrol-2-yl)methanone Formula: C22H30N4O4S MolecularWeight: 446.563

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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)N4CCOCC4)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=CC(=CN3C)S(=O)(=O)N4CCOCC4)C

InChI

InChI=1S/C22H30N4O4S/c1-17-5-4-6-20(18(17)2)24-7-9-25(10-8-24)22(27)21-15-19(16-23(21)3)31(28,29)26-11-13-30-14-12-26/h4-6,15-16H,7-14H2,1-3H3