6-oxidanylidene-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]-1-phenyl-2,5-dihydro-1,2,4-triazine-3-carboxamide

Systemtic Name: 6-oxidanylidene-N-[[4-(3-oxidanylidenepiperazin-1-yl)phenyl]methyl]-1-phenyl-2,5-dihydro-1,2,4-triazine-3-carboxamide Openeye Name: 6-oxo-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]-1-phenyl-2,5-dihydro-1,2,4-triazine-3-carboxamide CAS Name: 6-oxo-N-[[4-(3-oxo-1-piperazinyl)phenyl]methyl]-1-phenyl-2,5-dihydro-1,2,4-triazine-3-carboxamide IUPAC Name: 6-oxo-N-[[4-(3-oxopiperazin-1-yl)phenyl]methyl]-1-phenyl-2,5-dihydro-1,2,4-triazine-3-carboxamide Traditional Name: 6-keto-N-[4-(3-ketopiperazino)benzyl]-1-phenyl-2,5-dihydro-1,2,4-triazine-3-carboxamide Formula: C21H22N6O3 MolecularWeight: 406.43778

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=CC=C(C=C2)CNC(=O)C3=NCC(=O)N(N3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC(=O)N1)C2=CC=C(C=C2)CNC(=O)C3=NCC(=O)N(N3)C4=CC=CC=C4

InChI

InChI=1S/C21H22N6O3/c28-18-14-26(11-10-22-18)16-8-6-15(7-9-16)12-24-21(30)20-23-13-19(29)27(25-20)17-4-2-1-3-5-17/h1-9H,10-14H2,(H,22,28)(H,23,25)(H,24,30)