4-[[5-(benzotriazol-1-ylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-2-one

Systemtic Name: 4-[[5-(benzotriazol-1-ylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-2-one Openeye Name: 4-[[5-(benzotriazol-1-ylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-2-one CAS Name: 4-[[[5-(1-benzotriazolylmethyl)-4-methyl-1,2,4-triazol-3-yl]thio]methyl]-1H-quinolin-2-one IUPAC Name: 4-[[5-(benzotriazol-1-ylmethyl)-4-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-1H-quinolin-2-one Traditional Name: 4-[[[5-(benzotriazol-1-ylmethyl)-4-methyl-1,2,4-triazol-3-yl]thio]methyl]carbostyril Formula: C20H17N7OS MolecularWeight: 403.46028

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC(=O)NC3=CC=CC=C32)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

CN1C(=NN=C1SCC2=CC(=O)NC3=CC=CC=C32)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C20H17N7OS/c1-26-18(11-27-17-9-5-4-8-16(17)22-25-27)23-24-20(26)29-12-13-10-19(28)21-15-7-3-2-6-14(13)15/h2-10H,11-12H2,1H3,(H,21,28)