3-[(6-methyl-2-propan-2-yl-pyrimidin-4-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[(6-methyl-2-propan-2-yl-pyrimidin-4-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[(2-isopropyl-6-methyl-pyrimidin-4-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[(6-methyl-2-propan-2-yl-4-pyrimidinyl)thio]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[(6-methyl-2-propan-2-ylpyrimidin-4-yl)sulfanylmethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[(2-isopropyl-6-methyl-pyrimidin-4-yl)thio]methyl]-1,2,3-benzotriazin-4-one Formula: C16H17N5OS MolecularWeight: 327.40408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)SCN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)SCN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C16H17N5OS/c1-10(2)15-17-11(3)8-14(18-15)23-9-21-16(22)12-6-4-5-7-13(12)19-20-21/h4-8,10H,9H2,1-3H3