1-[(4-methyl-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl)methyl]benzotriazole

Systemtic Name: 1-[(4-methyl-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl)methyl]benzotriazole Openeye Name: 1-[(5-isopropylsulfanyl-4-methyl-1,2,4-triazol-3-yl)methyl]benzotriazole CAS Name: 1-[[4-methyl-5-(propan-2-ylthio)-1,2,4-triazol-3-yl]methyl]benzotriazole IUPAC Name: 1-[(4-methyl-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl)methyl]benzotriazole Traditional Name: 1-[[5-(isopropylthio)-4-methyl-1,2,4-triazol-3-yl]methyl]benzotriazole Formula: C13H16N6S MolecularWeight: 288.37134

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NN=C(N1C)CN2C3=CC=CC=C3N=N2

Isomeric SMILES

CC(C)SC1=NN=C(N1C)CN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C13H16N6S/c1-9(2)20-13-16-15-12(18(13)3)8-19-11-7-5-4-6-10(11)14-17-19/h4-7,9H,8H2,1-3H3