N-[(4-chlorophenyl)methyl]-4-oxidanylidene-2-sulfanylidene-3-(2H-1,2,3,4-tetrazol-5-yl)-1H-quinazoline-7-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-4-oxidanylidene-2-sulfanylidene-3-(2H-1,2,3,4-tetrazol-5-yl)-1H-quinazoline-7-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-4-oxo-3-(2H-tetrazol-5-yl)-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-4-oxo-2-sulfanylidene-3-(2H-tetrazol-5-yl)-1H-quinazoline-7-carboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-4-oxo-2-sulfanylidene-3-(2H-tetrazol-5-yl)-1H-quinazoline-7-carboxamide Traditional Name: N-(4-chlorobenzyl)-4-keto-3-(2H-tetrazol-5-yl)-2-thioxo-1H-quinazoline-7-carboxamide Formula: C17H12ClN7O2S MolecularWeight: 413.84088

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)C4=NNN=N4)Cl

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)C4=NNN=N4)Cl

InChI

InChI=1S/C17H12ClN7O2S/c18-11-4-1-9(2-5-11)8-19-14(26)10-3-6-12-13(7-10)20-17(28)25(15(12)27)16-21-23-24-22-16/h1-7H,8H2,(H,19,26)(H,20,28)(H,21,22,23,24)