2-[7-chloranyl-4-oxidanylidene-3-(2-oxidanylpropyl)quinazolin-2-yl]sulfanyl-N-pentan-3-yl-ethanamide

Systemtic Name: 2-[7-chloranyl-4-oxidanylidene-3-(2-oxidanylpropyl)quinazolin-2-yl]sulfanyl-N-pentan-3-yl-ethanamide Openeye Name: 2-[7-chloro-3-(2-hydroxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(1-ethylpropyl)acetamide CAS Name: 2-[[7-chloro-3-(2-hydroxypropyl)-4-oxo-2-quinazolinyl]thio]-N-pentan-3-ylacetamide IUPAC Name: 2-[7-chloro-3-(2-hydroxypropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-pentan-3-ylacetamide Traditional Name: 2-[[7-chloro-3-(2-hydroxypropyl)-4-keto-quinazolin-2-yl]thio]-N-(1-ethylpropyl)acetamide Formula: C18H24ClN3O3S MolecularWeight: 397.91946

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC(C)O

Isomeric SMILES

CCC(CC)NC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC(C)O

InChI

InChI=1S/C18H24ClN3O3S/c1-4-13(5-2)20-16(24)10-26-18-21-15-8-12(19)6-7-14(15)17(25)22(18)9-11(3)23/h6-8,11,13,23H,4-5,9-10H2,1-3H3,(H,20,24)