[4-(2,5-dimethylpyrrol-1-yl)phenyl]-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [4-(2,5-dimethylpyrrol-1-yl)phenyl]-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]methanone Openeye Name: [4-(2,5-dimethylpyrrol-1-yl)phenyl]-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]methanone CAS Name: [4-(2,5-dimethyl-1-pyrrolyl)phenyl]-[4-[(4-methyl-1-piperazinyl)sulfonyl]-1-piperazinyl]methanone IUPAC Name: [4-(2,5-dimethylpyrrol-1-yl)phenyl]-[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]methanone Traditional Name: [4-(2,5-dimethylpyrrol-1-yl)phenyl]-[4-(4-methylpiperazino)sulfonylpiperazino]methanone Formula: C22H31N5O3S MolecularWeight: 445.57824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)N4CCN(CC4)C)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)N4CCN(CC4)C)C

InChI

InChI=1S/C22H31N5O3S/c1-18-4-5-19(2)27(18)21-8-6-20(7-9-21)22(28)24-12-16-26(17-13-24)31(29,30)25-14-10-23(3)11-15-25/h4-9H,10-17H2,1-3H3