(8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-(5-thiophen-3-yl-1,2,3,4-tetrazol-2-yl)ethanoate

Systemtic Name: (8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-(5-thiophen-3-yl-1,2,3,4-tetrazol-2-yl)ethanoate Openeye Name: (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl 2-[5-(3-thienyl)tetrazol-2-yl]acetate CAS Name: 2-[5-(3-thiophenyl)-2-tetrazolyl]acetic acid (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl 2-(5-thiophen-3-yltetrazol-2-yl)acetate Traditional Name: 2-[5-(3-thienyl)tetrazol-2-yl]acetic acid (4-keto-8-methyl-1H-quinazolin-2-yl)methyl ester Formula: C17H14N6O3S MolecularWeight: 382.39646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=NC2=O)COC(=O)CN3N=C(N=N3)C4=CSC=C4

Isomeric SMILES

CC1=CC=CC2=C1NC(=NC2=O)COC(=O)CN3N=C(N=N3)C4=CSC=C4

InChI

InChI=1S/C17H14N6O3S/c1-10-3-2-4-12-15(10)18-13(19-17(12)25)8-26-14(24)7-23-21-16(20-22-23)11-5-6-27-9-11/h2-6,9H,7-8H2,1H3,(H,18,19,25)