1-[9,10-bis(oxidanylidene)anthracen-1-yl]-3-(2-methoxy-4-nitro-phenyl)thiourea

Systemtic Name: 1-[9,10-bis(oxidanylidene)anthracen-1-yl]-3-(2-methoxy-4-nitro-phenyl)thiourea Openeye Name: 1-(9,10-dioxo-1-anthryl)-3-(2-methoxy-4-nitro-phenyl)thiourea CAS Name: 1-(9,10-dioxo-1-anthracenyl)-3-(2-methoxy-4-nitrophenyl)thiourea IUPAC Name: 1-(9,10-dioxoanthracen-1-yl)-3-(2-methoxy-4-nitrophenyl)thiourea Traditional Name: 1-(9,10-diketo-1-anthryl)-3-(2-methoxy-4-nitro-phenyl)thiourea Formula: C22H15N3O5S MolecularWeight: 433.4366

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=S)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H15N3O5S/c1-30-18-11-12(25(28)29)9-10-16(18)23-22(31)24-17-8-4-7-15-19(17)21(27)14-6-3-2-5-13(14)20(15)26/h2-11H,1H3,(H2,23,24,31)