N-[(2,4-dichlorophenyl)methyl]-2-[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[(2,4-dichlorophenyl)methyl]-2-[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[(2,4-dichlorophenyl)methyl]-2-[3-(4-ethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[(2,4-dichlorophenyl)methyl]-2-[[3-(4-ethylphenyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-[(2,4-dichlorophenyl)methyl]-2-[3-(4-ethylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-(2,4-dichlorobenzyl)-2-[[3-(4-ethylphenyl)-4-keto-quinazolin-2-yl]thio]acetamide Formula: C25H21Cl2N3O2S MolecularWeight: 498.42414

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C25H21Cl2N3O2S/c1-2-16-7-11-19(12-8-16)30-24(32)20-5-3-4-6-22(20)29-25(30)33-15-23(31)28-14-17-9-10-18(26)13-21(17)27/h3-13H,2,14-15H2,1H3,(H,28,31)