propyl 4-[3-[(4-aminophenyl)sulfonylamino]-2,5-bis(oxidanylidene)-4-phenylsulfanyl-pyrrol-1-yl]benzoate

Systemtic Name: propyl 4-[3-[(4-aminophenyl)sulfonylamino]-2,5-bis(oxidanylidene)-4-phenylsulfanyl-pyrrol-1-yl]benzoate Openeye Name: propyl 4-[3-[(4-aminophenyl)sulfonylamino]-2,5-dioxo-4-phenylsulfanyl-pyrrol-1-yl]benzoate CAS Name: 4-[3-[(4-aminophenyl)sulfonylamino]-2,5-dioxo-4-(phenylthio)-1-pyrrolyl]benzoic acid propyl ester IUPAC Name: propyl 4-[3-[(4-aminophenyl)sulfonylamino]-2,5-dioxo-4-phenylsulfanylpyrrol-1-yl]benzoate Traditional Name: 4-[2,5-diketo-3-(phenylthio)-4-(sulfanilylamino)-3-pyrrolin-1-yl]benzoic acid propyl ester Formula: C26H23N3O6S2 MolecularWeight: 537.60732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H23N3O6S2/c1-2-16-35-26(32)17-8-12-19(13-9-17)29-24(30)22(23(25(29)31)36-20-6-4-3-5-7-20)28-37(33,34)21-14-10-18(27)11-15-21/h3-15,28H,2,16,27H2,1H3