1-[2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoylamino]-1-(4-fluorophenyl)thiourea

Systemtic Name: 1-[2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoylamino]-1-(4-fluorophenyl)thiourea Openeye Name: 1-[[2-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]amino]-1-(4-fluorophenyl)thiourea CAS Name: 1-[[2-[(3-ethyl-4-oxo-2-quinazolinyl)thio]-1-oxoethyl]amino]-1-(4-fluorophenyl)thiourea IUPAC Name: 1-[[2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylacetyl]amino]-1-(4-fluorophenyl)thiourea Traditional Name: 1-[[2-[(3-ethyl-4-keto-quinazolin-2-yl)thio]acetyl]amino]-1-(4-fluorophenyl)thiourea Formula: C19H18FN5O2S2 MolecularWeight: 431.506923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NN(C3=CC=C(C=C3)F)C(=S)N

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NN(C3=CC=C(C=C3)F)C(=S)N

InChI

InChI=1S/C19H18FN5O2S2/c1-2-24-17(27)14-5-3-4-6-15(14)22-19(24)29-11-16(26)23-25(18(21)28)13-9-7-12(20)8-10-13/h3-10H,2,11H2,1H3,(H2,21,28)(H,23,26)