1-[9,10-bis(oxidanylidene)anthracen-1-yl]-3-(4-butan-2-ylphenyl)thiourea

Systemtic Name: 1-[9,10-bis(oxidanylidene)anthracen-1-yl]-3-(4-butan-2-ylphenyl)thiourea Openeye Name: 1-(9,10-dioxo-1-anthryl)-3-(4-sec-butylphenyl)thiourea CAS Name: 1-(4-butan-2-ylphenyl)-3-(9,10-dioxo-1-anthracenyl)thiourea IUPAC Name: 1-(4-butan-2-ylphenyl)-3-(9,10-dioxoanthracen-1-yl)thiourea Traditional Name: 1-(9,10-diketo-1-anthryl)-3-(4-sec-butylphenyl)thiourea Formula: C25H22N2O2S MolecularWeight: 414.51938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H22N2O2S/c1-3-15(2)16-11-13-17(14-12-16)26-25(30)27-21-10-6-9-20-22(21)24(29)19-8-5-4-7-18(19)23(20)28/h4-15H,3H2,1-2H3,(H2,26,27,30)