dimethyl 5-[[9,10-bis(oxidanylidene)anthracen-1-yl]carbamothioylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-[[9,10-bis(oxidanylidene)anthracen-1-yl]carbamothioylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-[(9,10-dioxo-1-anthryl)carbamothioylamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[[(9,10-dioxo-1-anthracenyl)amino]-sulfanylidenemethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[(9,10-dioxoanthracen-1-yl)carbamothioylamino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[(9,10-diketo-1-anthryl)thiocarbamoylamino]-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C24H18N2O6S2 MolecularWeight: 494.53952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=S)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=S)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O)C(=O)OC

InChI

InChI=1S/C24H18N2O6S2/c1-11-16(22(29)31-2)21(34-20(11)23(30)32-3)26-24(33)25-15-10-6-9-14-17(15)19(28)13-8-5-4-7-12(13)18(14)27/h4-10H,1-3H3,(H2,25,26,33)