3-[(4-methyl-5-oxidanylidene-[1,2,4]triazolo[4,3-a]quinazolin-1-yl)methyl-(phenylmethyl)amino]propanamide

Systemtic Name: 3-[(4-methyl-5-oxidanylidene-[1,2,4]triazolo[4,3-a]quinazolin-1-yl)methyl-(phenylmethyl)amino]propanamide Openeye Name: 3-[benzyl-[(4-methyl-5-oxo-[1,2,4]triazolo[4,3-a]quinazolin-1-yl)methyl]amino]propanamide CAS Name: 3-[(4-methyl-5-oxo-[1,2,4]triazolo[4,3-a]quinazolin-1-yl)methyl-(phenylmethyl)amino]propanamide IUPAC Name: 3-[benzyl-[(4-methyl-5-oxo-[1,2,4]triazolo[4,3-a]quinazolin-1-yl)methyl]amino]propanamide Traditional Name: 3-[benzyl-[(5-keto-4-methyl-[1,2,4]triazolo[4,3-a]quinazolin-1-yl)methyl]amino]propionamide Formula: C21H22N6O2 MolecularWeight: 390.43838

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2N3C1=NN=C3CN(CCC(=O)N)CC4=CC=CC=C4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2N3C1=NN=C3CN(CCC(=O)N)CC4=CC=CC=C4

InChI

InChI=1S/C21H22N6O2/c1-25-20(29)16-9-5-6-10-17(16)27-19(23-24-21(25)27)14-26(12-11-18(22)28)13-15-7-3-2-4-8-15/h2-10H,11-14H2,1H3,(H2,22,28)