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

Systemtic Name: 1-[9,10-bis(oxidanylidene)anthracen-1-yl]-3-(4-bromanyl-2-chloranyl-phenyl)thiourea Openeye Name: 1-(4-bromo-2-chloro-phenyl)-3-(9,10-dioxo-1-anthryl)thiourea CAS Name: 1-(4-bromo-2-chlorophenyl)-3-(9,10-dioxo-1-anthracenyl)thiourea IUPAC Name: 1-(4-bromo-2-chlorophenyl)-3-(9,10-dioxoanthracen-1-yl)thiourea Traditional Name: 1-(4-bromo-2-chloro-phenyl)-3-(9,10-diketo-1-anthryl)thiourea Formula: C21H12BrClN2O2S MolecularWeight: 471.75418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NC(=S)NC4=C(C=C(C=C4)Br)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=CC=C3)NC(=S)NC4=C(C=C(C=C4)Br)Cl

InChI

InChI=1S/C21H12BrClN2O2S/c22-11-8-9-16(15(23)10-11)24-21(28)25-17-7-3-6-14-18(17)20(27)13-5-2-1-4-12(13)19(14)26/h1-10H,(H2,24,25,28)