2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-ethyl-ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(7-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-ethyl-ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethyl-acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethylacetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-[(7-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethylacetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-[(7-chloro-4-keto-1H-quinazolin-2-yl)methyl]-N-ethyl-acetamide Formula: C20H17ClN4O2S2 MolecularWeight: 444.95758

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=O)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCN(CC1=NC(=O)C2=C(N1)C=C(C=C2)Cl)C(=O)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H17ClN4O2S2/c1-2-25(10-17-22-15-9-12(21)7-8-13(15)19(27)24-17)18(26)11-28-20-23-14-5-3-4-6-16(14)29-20/h3-9H,2,10-11H2,1H3,(H,22,24,27)