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

Systemtic Name: 1-[2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoylamino]-3-(4-methylphenyl)thiourea Openeye Name: 1-[[2-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]amino]-3-(p-tolyl)thiourea CAS Name: 1-[[2-[(3-ethyl-4-oxo-2-quinazolinyl)thio]-1-oxoethyl]amino]-3-(4-methylphenyl)thiourea IUPAC Name: 1-[[2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylacetyl]amino]-3-(4-methylphenyl)thiourea Traditional Name: 1-[[2-[(3-ethyl-4-keto-quinazolin-2-yl)thio]acetyl]amino]-3-(p-tolyl)thiourea Formula: C20H21N5O2S2 MolecularWeight: 427.54304

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NNC(=S)NC3=CC=C(C=C3)C

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NNC(=S)NC3=CC=C(C=C3)C

InChI

InChI=1S/C20H21N5O2S2/c1-3-25-18(27)15-6-4-5-7-16(15)22-20(25)29-12-17(26)23-24-19(28)21-14-10-8-13(2)9-11-14/h4-11H,3,12H2,1-2H3,(H,23,26)(H2,21,24,28)