1-(3-chlorophenyl)-3-[[4-(4-oxidanylidene-2-phenyl-quinazolin-3-yl)phenyl]carbonylamino]thiourea

Systemtic Name: 1-(3-chlorophenyl)-3-[[4-(4-oxidanylidene-2-phenyl-quinazolin-3-yl)phenyl]carbonylamino]thiourea Openeye Name: 1-(3-chlorophenyl)-3-[[4-(4-oxo-2-phenyl-quinazolin-3-yl)benzoyl]amino]thiourea CAS Name: 1-(3-chlorophenyl)-3-[[oxo-[4-(4-oxo-2-phenyl-3-quinazolinyl)phenyl]methyl]amino]thiourea IUPAC Name: 1-(3-chlorophenyl)-3-[[4-(4-oxo-2-phenylquinazolin-3-yl)benzoyl]amino]thiourea Traditional Name: 1-(3-chlorophenyl)-3-[[4-(4-keto-2-phenyl-quinazolin-3-yl)benzoyl]amino]thiourea Formula: C28H20ClN5O2S MolecularWeight: 526.0087

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)C(=O)NNC(=S)NC5=CC(=CC=C5)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)C(=O)NNC(=S)NC5=CC(=CC=C5)Cl

InChI

InChI=1S/C28H20ClN5O2S/c29-20-9-6-10-21(17-20)30-28(37)33-32-26(35)19-13-15-22(16-14-19)34-25(18-7-2-1-3-8-18)31-24-12-5-4-11-23(24)27(34)36/h1-17H,(H,32,35)(H2,30,33,37)