4-azanyl-N-[1-(4-butylphenyl)-4-(4-methylphenyl)sulfanyl-2,5-bis(oxidanylidene)pyrrol-3-yl]benzenesulfonamide

Systemtic Name: 4-azanyl-N-[1-(4-butylphenyl)-4-(4-methylphenyl)sulfanyl-2,5-bis(oxidanylidene)pyrrol-3-yl]benzenesulfonamide Openeye Name: 4-amino-N-[1-(4-butylphenyl)-2,5-dioxo-4-(p-tolylsulfanyl)pyrrol-3-yl]benzenesulfonamide CAS Name: 4-amino-N-[1-(4-butylphenyl)-4-[(4-methylphenyl)thio]-2,5-dioxo-3-pyrrolyl]benzenesulfonamide IUPAC Name: 4-amino-N-[1-(4-butylphenyl)-4-(4-methylphenyl)sulfanyl-2,5-dioxopyrrol-3-yl]benzenesulfonamide Traditional Name: 4-amino-N-[1-(4-butylphenyl)-2,5-diketo-4-(p-tolylthio)-3-pyrrolin-3-yl]benzenesulfonamide Formula: C27H27N3O4S2 MolecularWeight: 521.65098

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)SC3=CC=C(C=C3)C)NS(=O)(=O)C4=CC=C(C=C4)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)SC3=CC=C(C=C3)C)NS(=O)(=O)C4=CC=C(C=C4)N

InChI

InChI=1S/C27H27N3O4S2/c1-3-4-5-19-8-12-21(13-9-19)30-26(31)24(29-36(33,34)23-16-10-20(28)11-17-23)25(27(30)32)35-22-14-6-18(2)7-15-22/h6-17,29H,3-5,28H2,1-2H3