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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)CCNC(=O)CCN3C(=O)C4=CC=CC=C4N=N3

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)CCNC(=O)CCN3C(=O)C4=CC=CC=C4N=N3

InChI

InChI=1S/C21H20N6O2/c28-20(11-13-26-21(29)18-8-4-5-9-19(18)24-25-26)22-12-10-16-14-23-27(15-16)17-6-2-1-3-7-17/h1-9,14-15H,10-13H2,(H,22,28)