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

Systemtic Name: 1-ethyl-3-[2-[3-(4-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoylamino]thiourea Openeye Name: 1-ethyl-3-[[2-[3-(4-methoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanylacetyl]amino]thiourea CAS Name: 1-ethyl-3-[[2-[[3-(4-methoxyphenyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]amino]thiourea IUPAC Name: 1-ethyl-3-[[2-[3-(4-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]amino]thiourea Traditional Name: 1-ethyl-3-[[2-[[4-keto-3-(4-methoxyphenyl)quinazolin-2-yl]thio]acetyl]amino]thiourea Formula: C20H21N5O3S2 MolecularWeight: 443.54244

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OC

Isomeric SMILES

CCNC(=S)NNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H21N5O3S2/c1-3-21-19(29)24-23-17(26)12-30-20-22-16-7-5-4-6-15(16)18(27)25(20)13-8-10-14(28-2)11-9-13/h4-11H,3,12H2,1-2H3,(H,23,26)(H2,21,24,29)