5-sulfanylidene-1,6-dihydro-[1,2,3]triazolo[5,1-d][1,3,5]benzotriazepine-3-carboxamide

Systemtic Name: 5-sulfanylidene-1,6-dihydro-[1,2,3]triazolo[5,1-d][1,3,5]benzotriazepine-3-carboxamide Openeye Name: 5-thioxo-1,6-dihydrotriazolo[5,1-d][1,3,5]benzotriazepine-3-carboxamide CAS Name: 5-sulfanylidene-1,6-dihydrotriazolo[5,1-d][1,3,5]benzotriazepine-3-carboxamide IUPAC Name: 5-sulfanylidene-1,6-dihydrotriazolo[5,1-d][1,3,5]benzotriazepine-3-carboxamide Traditional Name: 5-thioxo-1,6-dihydrotriazolo[5,1-d][1,3,5]benzotriazepine-3-carboxamide Formula: C10H8N6OS MolecularWeight: 260.27512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=S)N=C3N2NN=C3C(=O)N

Isomeric SMILES

C1=CC=C2C(=C1)NC(=S)N=C3N2NN=C3C(=O)N

InChI

InChI=1S/C10H8N6OS/c11-8(17)7-9-13-10(18)12-5-3-1-2-4-6(5)16(9)15-14-7/h1-4,15H,(H2,11,17)(H,12,18)