3-[2-[(2S)-2-methyl-1-methylsulfonyl-2,3-dihydroindol-5-yl]-2-oxidanylidene-ethyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[2-[(2S)-2-methyl-1-methylsulfonyl-2,3-dihydroindol-5-yl]-2-oxidanylidene-ethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[2-[(2S)-2-methyl-1-methylsulfonyl-indolin-5-yl]-2-oxo-ethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[2-[(2S)-2-methyl-1-methylsulfonyl-2,3-dihydroindol-5-yl]-2-oxoethyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[2-[(2S)-2-methyl-1-methylsulfonyl-2,3-dihydroindol-5-yl]-2-oxoethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[2-keto-2-[(2S)-1-mesyl-2-methyl-indolin-5-yl]ethyl]-1,2,3-benzotriazin-4-one Formula: C19H18N4O4S MolecularWeight: 398.43562

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)CN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

C[C@H]1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)CN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C19H18N4O4S/c1-12-9-14-10-13(7-8-17(14)23(12)28(2,26)27)18(24)11-22-19(25)15-5-3-4-6-16(15)20-21-22/h3-8,10,12H,9,11H2,1-2H3/t12-/m0/s1