methyl 3-[4-oxidanylidene-2-[(1-propyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]quinazolin-3-yl]propanoate

Systemtic Name: methyl 3-[4-oxidanylidene-2-[(1-propyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]quinazolin-3-yl]propanoate Openeye Name: methyl 3-[4-oxo-2-[(1-propyltetrazol-5-yl)methylsulfanyl]quinazolin-3-yl]propanoate CAS Name: 3-[4-oxo-2-[(1-propyl-5-tetrazolyl)methylthio]-3-quinazolinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-oxo-2-[(1-propyltetrazol-5-yl)methylsulfanyl]quinazolin-3-yl]propanoate Traditional Name: 3-[4-keto-2-[(1-propyltetrazol-5-yl)methylthio]quinazolin-3-yl]propionic acid methyl ester Formula: C17H20N6O3S MolecularWeight: 388.4441

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)CSC2=NC3=CC=CC=C3C(=O)N2CCC(=O)OC

Isomeric SMILES

CCCN1C(=NN=N1)CSC2=NC3=CC=CC=C3C(=O)N2CCC(=O)OC

InChI

InChI=1S/C17H20N6O3S/c1-3-9-23-14(19-20-21-23)11-27-17-18-13-7-5-4-6-12(13)16(25)22(17)10-8-15(24)26-2/h4-7H,3,8-11H2,1-2H3