N-(3-chloranyl-4-methyl-phenyl)-2-[4-oxidanylidene-3-(thiophen-2-ylmethyl)quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-[4-oxidanylidene-3-(thiophen-2-ylmethyl)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-[4-oxo-3-(2-thienylmethyl)quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(3-chloro-4-methylphenyl)-2-[[4-oxo-3-(thiophen-2-ylmethyl)-2-quinazolinyl]thio]acetamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-[4-oxo-3-(thiophen-2-ylmethyl)quinazolin-2-yl]sulfanylacetamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-2-[[4-keto-3-(2-thenyl)quinazolin-2-yl]thio]acetamide Formula: C22H18ClN3O2S2 MolecularWeight: 455.98022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CS4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CS4)Cl

InChI

InChI=1S/C22H18ClN3O2S2/c1-14-8-9-15(11-18(14)23)24-20(27)13-30-22-25-19-7-3-2-6-17(19)21(28)26(22)12-16-5-4-10-29-16/h2-11H,12-13H2,1H3,(H,24,27)