3-methyl-6-[[4-methyl-2-(trioxidanylsulfanyl)phenyl]amino]benzo[e]perimidine-2,7-dione

Systemtic Name: 3-methyl-6-[[4-methyl-2-(trioxidanylsulfanyl)phenyl]amino]benzo[e]perimidine-2,7-dione Openeye Name: 3-methyl-6-[4-methyl-2-(trioxidanylsulfanyl)anilino]benzo[e]perimidine-2,7-dione CAS Name: 5-methyl-2-[(3-methyl-2,7-dioxo-6-benzo[e]perimidinyl)amino]benzenesulfenic acid hydroperoxy ester IUPAC Name: 3-methyl-6-[4-methyl-2-(trioxidanylsulfanyl)anilino]benzo[e]perimidine-2,7-dione Traditional Name: 3-methyl-6-[4-methyl-2-(trioxidanylthio)anilino]benzo[e]perimidine-2,7-quinone Formula: C23H17N3O5S MolecularWeight: 447.46318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=C3C4=C(C=C2)N(C(=O)N=C4C5=CC=CC=C5C3=O)C)SOOO

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=C3C4=C(C=C2)N(C(=O)N=C4C5=CC=CC=C5C3=O)C)SOOO

InChI

InChI=1S/C23H17N3O5S/c1-12-7-8-15(18(11-12)32-31-30-29)24-16-9-10-17-20-19(16)22(27)14-6-4-3-5-13(14)21(20)25-23(28)26(17)2/h3-11,24,29H,1-2H3