[4-(azepan-1-ylsulfonyl)piperazin-1-yl]-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]methanone

Systemtic Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]methanone Openeye Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]methanone CAS Name: [4-(1-azepanylsulfonyl)-1-piperazinyl]-[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]methanone IUPAC Name: [4-(azepan-1-ylsulfonyl)piperazin-1-yl]-[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]methanone Traditional Name: [4-(azepan-1-ylsulfonyl)piperazino]-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]methanone Formula: C24H34N4O4S MolecularWeight: 474.61616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C(=O)N3CCN(CC3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)OC)C)C(=O)N3CCN(CC3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C24H34N4O4S/c1-19-18-23(20(2)28(19)21-8-10-22(32-3)11-9-21)24(29)25-14-16-27(17-15-25)33(30,31)26-12-6-4-5-7-13-26/h8-11,18H,4-7,12-17H2,1-3H3