1-[[1-azanyl-9,10-bis(oxidanylidene)anthracen-2-yl]carbonylamino]-3-(4-chlorophenyl)thiourea

Systemtic Name: 1-[[1-azanyl-9,10-bis(oxidanylidene)anthracen-2-yl]carbonylamino]-3-(4-chlorophenyl)thiourea Openeye Name: 1-[(1-amino-9,10-dioxo-anthracene-2-carbonyl)amino]-3-(4-chlorophenyl)thiourea CAS Name: 1-[[(1-amino-9,10-dioxo-2-anthracenyl)-oxomethyl]amino]-3-(4-chlorophenyl)thiourea IUPAC Name: 1-[(1-amino-9,10-dioxoanthracene-2-carbonyl)amino]-3-(4-chlorophenyl)thiourea Traditional Name: 1-[(1-amino-9,10-diketo-anthracene-2-carbonyl)amino]-3-(4-chlorophenyl)thiourea Formula: C22H15ClN4O3S MolecularWeight: 450.8975

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)C(=O)NNC(=S)NC4=CC=C(C=C4)Cl)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)C(=O)NNC(=S)NC4=CC=C(C=C4)Cl)N

InChI

InChI=1S/C22H15ClN4O3S/c23-11-5-7-12(8-6-11)25-22(31)27-26-21(30)16-10-9-15-17(18(16)24)20(29)14-4-2-1-3-13(14)19(15)28/h1-10H,24H2,(H,26,30)(H2,25,27,31)