[4-(2,4-dimethylphenyl)piperazin-1-yl]-(4-piperidin-1-ylsulfonyl-1H-pyrrol-2-yl)methanone

Systemtic Name: [4-(2,4-dimethylphenyl)piperazin-1-yl]-(4-piperidin-1-ylsulfonyl-1H-pyrrol-2-yl)methanone Openeye Name: [4-(2,4-dimethylphenyl)piperazin-1-yl]-[4-(1-piperidylsulfonyl)-1H-pyrrol-2-yl]methanone CAS Name: [4-(2,4-dimethylphenyl)-1-piperazinyl]-[4-(1-piperidinylsulfonyl)-1H-pyrrol-2-yl]methanone IUPAC Name: [4-(2,4-dimethylphenyl)piperazin-1-yl]-(4-piperidin-1-ylsulfonyl-1H-pyrrol-2-yl)methanone Traditional Name: [4-(2,4-dimethylphenyl)piperazino]-(4-piperidinosulfonyl-1H-pyrrol-2-yl)methanone Formula: C22H30N4O3S MolecularWeight: 430.5636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=CN3)S(=O)(=O)N4CCCCC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC(=CN3)S(=O)(=O)N4CCCCC4)C

InChI

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