N-methyl-3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)-N-[(1-phenylpyrazol-4-yl)methyl]propanamide

Systemtic Name: N-methyl-3-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)-N-[(1-phenylpyrazol-4-yl)methyl]propanamide Openeye Name: N-methyl-3-(4-oxo-1,2,3-benzotriazin-3-yl)-N-[(1-phenylpyrazol-4-yl)methyl]propanamide CAS Name: N-methyl-3-(4-oxo-1,2,3-benzotriazin-3-yl)-N-[(1-phenyl-4-pyrazolyl)methyl]propanamide IUPAC Name: N-methyl-3-(4-oxo-1,2,3-benzotriazin-3-yl)-N-[(1-phenylpyrazol-4-yl)methyl]propanamide Traditional Name: 3-(4-keto-1,2,3-benzotriazin-3-yl)-N-methyl-N-[(1-phenylpyrazol-4-yl)methyl]propionamide Formula: C21H20N6O2 MolecularWeight: 388.4225

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)C2=CC=CC=C2)C(=O)CCN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

CN(CC1=CN(N=C1)C2=CC=CC=C2)C(=O)CCN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C21H20N6O2/c1-25(14-16-13-22-27(15-16)17-7-3-2-4-8-17)20(28)11-12-26-21(29)18-9-5-6-10-19(18)23-24-26/h2-10,13,15H,11-12,14H2,1H3