1,4-bis(azanyl)-2-(3-methylphenyl)sulfanyl-anthracene-9,10-dione

Systemtic Name: 1,4-bis(azanyl)-2-(3-methylphenyl)sulfanyl-anthracene-9,10-dione Openeye Name: 1,4-diamino-2-(m-tolylsulfanyl)anthracene-9,10-dione CAS Name: 1,4-diamino-2-[(3-methylphenyl)thio]anthracene-9,10-dione IUPAC Name: 1,4-diamino-2-(3-methylphenyl)sulfanylanthracene-9,10-dione Traditional Name: 1,4-diamino-2-(m-tolylthio)-9,10-anthraquinone Formula: C21H16N2O2S MolecularWeight: 360.42894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)SC2=C(C3=C(C(=C2)N)C(=O)C4=CC=CC=C4C3=O)N

Isomeric SMILES

CC1=CC(=CC=C1)SC2=C(C3=C(C(=C2)N)C(=O)C4=CC=CC=C4C3=O)N

InChI

InChI=1S/C21H16N2O2S/c1-11-5-4-6-12(9-11)26-16-10-15(22)17-18(19(16)23)21(25)14-8-3-2-7-13(14)20(17)24/h2-10H,22-23H2,1H3