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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3C

Isomeric SMILES

CCNC(=S)NNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3C

InChI

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