N-[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)ethanamide

Systemtic Name: N-[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]-2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)ethanamide Openeye Name: N-[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide CAS Name: N-[(1S)-1-(4-ethylphenyl)-2-methylpropyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide IUPAC Name: N-[(1S)-1-(4-ethylphenyl)-2-methylpropyl]-2-(4-oxo-1,2,3-benzotriazin-3-yl)acetamide Traditional Name: N-[(1S)-1-(4-ethylphenyl)-2-methyl-propyl]-2-(4-keto-1,2,3-benzotriazin-3-yl)acetamide Formula: C21H24N4O2 MolecularWeight: 364.44086

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C(C)C)NC(=O)CN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C(C)C)NC(=O)CN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C21H24N4O2/c1-4-15-9-11-16(12-10-15)20(14(2)3)22-19(26)13-25-21(27)17-7-5-6-8-18(17)23-24-25/h5-12,14,20H,4,13H2,1-3H3,(H,22,26)/t20-/m0/s1