(2-phenyl-1,3-thiazol-4-yl)methyl 1-azanyl-9,10-bis(oxidanylidene)anthracene-2-carboxylate

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl 1-azanyl-9,10-bis(oxidanylidene)anthracene-2-carboxylate Openeye Name: (2-phenylthiazol-4-yl)methyl 1-amino-9,10-dioxo-anthracene-2-carboxylate CAS Name: 1-amino-9,10-dioxo-2-anthracenecarboxylic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl 1-amino-9,10-dioxoanthracene-2-carboxylate Traditional Name: 1-amino-9,10-diketo-anthracene-2-carboxylic acid (2-phenylthiazol-4-yl)methyl ester Formula: C25H16N2O4S MolecularWeight: 440.47054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3=C(C4=C(C=C3)C(=O)C5=CC=CC=C5C4=O)N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=CS2)COC(=O)C3=C(C4=C(C=C3)C(=O)C5=CC=CC=C5C4=O)N

InChI

InChI=1S/C25H16N2O4S/c26-21-19(11-10-18-20(21)23(29)17-9-5-4-8-16(17)22(18)28)25(30)31-12-15-13-32-24(27-15)14-6-2-1-3-7-14/h1-11,13H,12,26H2