1-oxidanylidene-N-phenethyl-4-(propan-2-ylamino)-2H-[1,2,4]triazolo[4,3-a]quinoxaline-8-carboxamide

Systemtic Name: 1-oxidanylidene-N-phenethyl-4-(propan-2-ylamino)-2H-[1,2,4]triazolo[4,3-a]quinoxaline-8-carboxamide Openeye Name: 4-(isopropylamino)-1-oxo-N-phenethyl-2H-[1,2,4]triazolo[4,3-a]quinoxaline-8-carboxamide CAS Name: 1-oxo-N-phenethyl-4-(propan-2-ylamino)-2H-[1,2,4]triazolo[4,3-a]quinoxaline-8-carboxamide IUPAC Name: 1-oxo-N-phenethyl-4-(propan-2-ylamino)-2H-[1,2,4]triazolo[4,3-a]quinoxaline-8-carboxamide Traditional Name: 4-(isopropylamino)-1-keto-N-phenethyl-2H-[1,2,4]triazolo[4,3-a]quinoxaline-8-carboxamide Formula: C21H22N6O2 MolecularWeight: 390.43838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC2=C(C=C(C=C2)C(=O)NCCC3=CC=CC=C3)N4C1=NNC4=O

Isomeric SMILES

CC(C)NC1=NC2=C(C=C(C=C2)C(=O)NCCC3=CC=CC=C3)N4C1=NNC4=O

InChI

InChI=1S/C21H22N6O2/c1-13(2)23-18-19-25-26-21(29)27(19)17-12-15(8-9-16(17)24-18)20(28)22-11-10-14-6-4-3-5-7-14/h3-9,12-13H,10-11H2,1-2H3,(H,22,28)(H,23,24)(H,26,29)