S-([1,2,4]triazolo[1,5-c]quinazolin-2-ylmethyl) carbamothioate

Systemtic Name: S-([1,2,4]triazolo[1,5-c]quinazolin-2-ylmethyl) carbamothioate Openeye Name: S-([1,2,4]triazolo[1,5-c]quinazolin-2-ylmethyl) carbamothioate CAS Name: carbamothioic acid S-([1,2,4]triazolo[1,5-c]quinazolin-2-ylmethyl) ester IUPAC Name: S-([1,2,4]triazolo[1,5-c]quinazolin-2-ylmethyl) carbamothioate Traditional Name: thiocarbamic acid S-([1,2,4]triazolo[1,5-c]quinazolin-2-ylmethyl) ester Formula: C11H9N5OS MolecularWeight: 259.28706

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=NC(=NN3C=N2)CSC(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)C3=NC(=NN3C=N2)CSC(=O)N

InChI

InChI=1S/C11H9N5OS/c12-11(17)18-5-9-14-10-7-3-1-2-4-8(7)13-6-16(10)15-9/h1-4,6H,5H2,(H2,12,17)