methyl 2-[4-oxidanylidene-2-[2-oxidanylidene-2-(pentylamino)ethyl]sulfanyl-quinazolin-3-yl]ethanoate

Systemtic Name: methyl 2-[4-oxidanylidene-2-[2-oxidanylidene-2-(pentylamino)ethyl]sulfanyl-quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[4-oxo-2-[2-oxo-2-(pentylamino)ethyl]sulfanyl-quinazolin-3-yl]acetate CAS Name: 2-[4-oxo-2-[[2-oxo-2-(pentylamino)ethyl]thio]-3-quinazolinyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-oxo-2-[2-oxo-2-(pentylamino)ethyl]sulfanylquinazolin-3-yl]acetate Traditional Name: 2-[2-[[2-(amylamino)-2-keto-ethyl]thio]-4-keto-quinazolin-3-yl]acetic acid methyl ester Formula: C18H23N3O4S MolecularWeight: 377.45792

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC(=O)OC

Isomeric SMILES

CCCCCNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC(=O)OC

InChI

InChI=1S/C18H23N3O4S/c1-3-4-7-10-19-15(22)12-26-18-20-14-9-6-5-8-13(14)17(24)21(18)11-16(23)25-2/h5-6,8-9H,3-4,7,10-12H2,1-2H3,(H,19,22)