N-[[9,10-bis(oxidanylidene)anthracen-2-yl]carbamothioyl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[[9,10-bis(oxidanylidene)anthracen-2-yl]carbamothioyl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[(9,10-dioxo-2-anthryl)carbamothioyl]-3,4,5-trimethoxy-benzamide CAS Name: N-[[(9,10-dioxo-2-anthracenyl)amino]-sulfanylidenemethyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[(9,10-dioxoanthracen-2-yl)carbamothioyl]-3,4,5-trimethoxybenzamide Traditional Name: N-[(9,10-diketo-2-anthryl)thiocarbamoyl]-3,4,5-trimethoxy-benzamide Formula: C25H20N2O6S MolecularWeight: 476.5011

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC(=S)NC2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NC(=S)NC2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C25H20N2O6S/c1-31-19-10-13(11-20(32-2)23(19)33-3)24(30)27-25(34)26-14-8-9-17-18(12-14)22(29)16-7-5-4-6-15(16)21(17)28/h4-12H,1-3H3,(H2,26,27,30,34)