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

Systemtic Name: [4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-(2,5-dimethyl-1-propan-2-yl-pyrrol-3-yl)methanone Openeye Name: [4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)methanone CAS Name: [4-(2,5-dimethoxyphenyl)sulfonyl-1-piperazinyl]-(2,5-dimethyl-1-propan-2-yl-3-pyrrolyl)methanone IUPAC Name: [4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]-(2,5-dimethyl-1-propan-2-ylpyrrol-3-yl)methanone Traditional Name: [4-(2,5-dimethoxyphenyl)sulfonylpiperazino]-(1-isopropyl-2,5-dimethyl-pyrrol-3-yl)methanone Formula: C22H31N3O5S MolecularWeight: 449.56364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C(C)C)C)C(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CC1=CC(=C(N1C(C)C)C)C(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C22H31N3O5S/c1-15(2)25-16(3)13-19(17(25)4)22(26)23-9-11-24(12-10-23)31(27,28)21-14-18(29-5)7-8-20(21)30-6/h7-8,13-15H,9-12H2,1-6H3