ethyl N-[2-[7-chloranyl-3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]carbamate

Systemtic Name: ethyl N-[2-[7-chloranyl-3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]carbamate Openeye Name: ethyl N-[2-[7-chloro-3-(3-methoxypropyl)-4-oxo-quinazolin-2-yl]sulfanylacetyl]carbamate CAS Name: N-[2-[[7-chloro-3-(3-methoxypropyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-[7-chloro-3-(3-methoxypropyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]carbamate Traditional Name: N-[2-[[7-chloro-4-keto-3-(3-methoxypropyl)quinazolin-2-yl]thio]acetyl]carbamic acid ethyl ester Formula: C17H20ClN3O5S MolecularWeight: 413.8758

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CCCOC

Isomeric SMILES

CCOC(=O)NC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CCCOC

InChI

InChI=1S/C17H20ClN3O5S/c1-3-26-17(24)20-14(22)10-27-16-19-13-9-11(18)5-6-12(13)15(23)21(16)7-4-8-25-2/h5-6,9H,3-4,7-8,10H2,1-2H3,(H,20,22,24)