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

Systemtic Name: (1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (1-cyclopropyl-2,5-dimethyl-3-pyrrolyl)-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (1-cyclopropyl-2,5-dimethylpyrrol-3-yl)-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (1-cyclopropyl-2,5-dimethyl-pyrrol-3-yl)-[4-(4-methoxyphenyl)sulfonylpiperazino]methanone Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2CC2)C)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC(=C(N1C2CC2)C)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C21H27N3O4S/c1-15-14-20(16(2)24(15)17-4-5-17)21(25)22-10-12-23(13-11-22)29(26,27)19-8-6-18(28-3)7-9-19/h6-9,14,17H,4-5,10-13H2,1-3H3