1-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-ethyl-3-(3-fluoranyl-4-methyl-phenyl)thiourea

Systemtic Name: 1-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-ethyl-3-(3-fluoranyl-4-methyl-phenyl)thiourea Openeye Name: 1-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-1-ethyl-3-(3-fluoro-4-methyl-phenyl)thiourea CAS Name: 1-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-1-ethyl-3-(3-fluoro-4-methylphenyl)thiourea IUPAC Name: 1-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-1-ethyl-3-(3-fluoro-4-methylphenyl)thiourea Traditional Name: 1-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl]-1-ethyl-3-(3-fluoro-4-methyl-phenyl)thiourea Formula: C19H18ClFN4OS MolecularWeight: 404.888823

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=S)NC3=CC(=C(C=C3)C)F

Isomeric SMILES

CCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=S)NC3=CC(=C(C=C3)C)F

InChI

InChI=1S/C19H18ClFN4OS/c1-3-25(19(27)22-13-6-4-11(2)15(21)9-13)10-17-23-16-8-12(20)5-7-14(16)18(26)24-17/h4-9H,3,10H2,1-2H3,(H,22,27)(H,23,24,26)