[4-[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonyl-1,2,5-trimethyl-pyrrol-3-yl]-piperidin-1-yl-methanone

Systemtic Name: [4-[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonyl-1,2,5-trimethyl-pyrrol-3-yl]-piperidin-1-yl-methanone Openeye Name: [4-[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonyl-1,2,5-trimethyl-pyrrol-3-yl]-(1-piperidyl)methanone CAS Name: [4-[[4-(2,5-dimethylphenyl)-1-piperazinyl]sulfonyl]-1,2,5-trimethyl-3-pyrrolyl]-(1-piperidinyl)methanone IUPAC Name: [4-[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonyl-1,2,5-trimethylpyrrol-3-yl]-piperidin-1-ylmethanone Traditional Name: [4-[4-(2,5-dimethylphenyl)piperazino]sulfonyl-1,2,5-trimethyl-pyrrol-3-yl]-piperidino-methanone Formula: C25H36N4O3S MolecularWeight: 472.64334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)S(=O)(=O)C3=C(N(C(=C3C(=O)N4CCCCC4)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)S(=O)(=O)C3=C(N(C(=C3C(=O)N4CCCCC4)C)C)C

InChI

InChI=1S/C25H36N4O3S/c1-18-9-10-19(2)22(17-18)27-13-15-29(16-14-27)33(31,32)24-21(4)26(5)20(3)23(24)25(30)28-11-7-6-8-12-28/h9-10,17H,6-8,11-16H2,1-5H3