2-[7-chloranyl-3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-methyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[7-chloranyl-3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-methyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[7-chloro-3-(3-methoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-methyl-acetamide CAS Name: 2-[[7-chloro-3-(3-methoxypropyl)-4-oxo-2-quinazolinyl]thio]-N-methyl-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[7-chloro-3-(3-methoxypropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-methylacetamide Traditional Name: N-benzyl-2-[[7-chloro-4-keto-3-(3-methoxypropyl)quinazolin-2-yl]thio]-N-methyl-acetamide Formula: C22H24ClN3O3S MolecularWeight: 445.96226

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCCOC

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCCOC

InChI

InChI=1S/C22H24ClN3O3S/c1-25(14-16-7-4-3-5-8-16)20(27)15-30-22-24-19-13-17(23)9-10-18(19)21(28)26(22)11-6-12-29-2/h3-5,7-10,13H,6,11-12,14-15H2,1-2H3