1-[9,10-bis(oxidanylidene)anthracen-1-yl]-3-(2-methoxy-5-methyl-phenyl)thiourea

Systemtic Name: 1-[9,10-bis(oxidanylidene)anthracen-1-yl]-3-(2-methoxy-5-methyl-phenyl)thiourea Openeye Name: 1-(9,10-dioxo-1-anthryl)-3-(2-methoxy-5-methyl-phenyl)thiourea CAS Name: 1-(9,10-dioxo-1-anthracenyl)-3-(2-methoxy-5-methylphenyl)thiourea IUPAC Name: 1-(9,10-dioxoanthracen-1-yl)-3-(2-methoxy-5-methylphenyl)thiourea Traditional Name: 1-(9,10-diketo-1-anthryl)-3-(2-methoxy-5-methyl-phenyl)thiourea Formula: C23H18N2O3S MolecularWeight: 402.46562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=S)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=S)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H18N2O3S/c1-13-10-11-19(28-2)18(12-13)25-23(29)24-17-9-5-8-16-20(17)22(27)15-7-4-3-6-14(15)21(16)26/h3-12H,1-2H3,(H2,24,25,29)