[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)methanone

Systemtic Name: [4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)methanone Openeye Name: [4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)methanone CAS Name: [4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-(1-ethyl-2,5-dimethyl-3-pyrrolyl)methanone IUPAC Name: [4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-(1-ethyl-2,5-dimethylpyrrol-3-yl)methanone Traditional Name: [4-(2,5-dimethylphenyl)sulfonylpiperazino]-(1-ethyl-2,5-dimethyl-pyrrol-3-yl)methanone Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=C1C)C(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C)C)C

Isomeric SMILES

CCN1C(=CC(=C1C)C(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C)C)C

InChI

InChI=1S/C21H29N3O3S/c1-6-24-17(4)14-19(18(24)5)21(25)22-9-11-23(12-10-22)28(26,27)20-13-15(2)7-8-16(20)3/h7-8,13-14H,6,9-12H2,1-5H3