3-[(4-fluorophenyl)methyl]-1-(2-methoxyethyl)-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]thiourea

Systemtic Name: 3-[(4-fluorophenyl)methyl]-1-(2-methoxyethyl)-1-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]thiourea Openeye Name: 3-[(4-fluorophenyl)methyl]-1-(2-methoxyethyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea CAS Name: 3-[(4-fluorophenyl)methyl]-1-(2-methoxyethyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea IUPAC Name: 3-[(4-fluorophenyl)methyl]-1-(2-methoxyethyl)-1-[(4-oxo-1H-quinazolin-2-yl)methyl]thiourea Traditional Name: 3-(4-fluorobenzyl)-1-[(4-keto-1H-quinazolin-2-yl)methyl]-1-(2-methoxyethyl)thiourea Formula: C20H21FN4O2S MolecularWeight: 400.469743

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=S)NCC3=CC=C(C=C3)F

Isomeric SMILES

COCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=S)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C20H21FN4O2S/c1-27-11-10-25(20(28)22-12-14-6-8-15(21)9-7-14)13-18-23-17-5-3-2-4-16(17)19(26)24-18/h2-9H,10-13H2,1H3,(H,22,28)(H,23,24,26)