2-[[ethyl-[(4-phenyl-5-sulfanylidene-1,2,3,4-tetrazol-1-yl)methyl]amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[ethyl-[(4-phenyl-5-sulfanylidene-1,2,3,4-tetrazol-1-yl)methyl]amino]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[ethyl-[(4-phenyl-5-thioxo-tetrazol-1-yl)methyl]amino]methyl]-1H-quinazolin-4-one CAS Name: 2-[[ethyl-[(4-phenyl-5-sulfanylidene-1-tetrazolyl)methyl]amino]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[ethyl-[(4-phenyl-5-sulfanylidenetetrazol-1-yl)methyl]amino]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[ethyl-[(4-phenyl-5-thioxo-tetrazol-1-yl)methyl]amino]methyl]-1H-quinazolin-4-one Formula: C19H19N7OS MolecularWeight: 393.46546

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=CC=CC=C2N1)CN3C(=S)N(N=N3)C4=CC=CC=C4

Isomeric SMILES

CCN(CC1=NC(=O)C2=CC=CC=C2N1)CN3C(=S)N(N=N3)C4=CC=CC=C4

InChI

InChI=1S/C19H19N7OS/c1-2-24(12-17-20-16-11-7-6-10-15(16)18(27)21-17)13-25-19(28)26(23-22-25)14-8-4-3-5-9-14/h3-11H,2,12-13H2,1H3,(H,20,21,27)