1-[(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-ethyl-3-(4-fluorophenyl)thiourea

Systemtic Name: 1-[(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-1-ethyl-3-(4-fluorophenyl)thiourea Openeye Name: 1-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl]-1-ethyl-3-(4-fluorophenyl)thiourea CAS Name: 1-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl]-1-ethyl-3-(4-fluorophenyl)thiourea IUPAC Name: 1-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl]-1-ethyl-3-(4-fluorophenyl)thiourea Traditional Name: 1-ethyl-3-(4-fluorophenyl)-1-[(4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)methyl]thiourea Formula: C20H21FN4O3S MolecularWeight: 416.469143

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=CC(=C(C=C2N1)OC)OC)C(=S)NC3=CC=C(C=C3)F

Isomeric SMILES

CCN(CC1=NC(=O)C2=CC(=C(C=C2N1)OC)OC)C(=S)NC3=CC=C(C=C3)F

InChI

InChI=1S/C20H21FN4O3S/c1-4-25(20(29)22-13-7-5-12(21)6-8-13)11-18-23-15-10-17(28-3)16(27-2)9-14(15)19(26)24-18/h5-10H,4,11H2,1-3H3,(H,22,29)(H,23,24,26)