5-[2-(4-methylpiperazin-1-yl)ethanoylamino]-1-(phenylmethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-[2-(4-methylpiperazin-1-yl)ethanoylamino]-1-(phenylmethyl)-1,2,3-triazole-4-carboxamide Openeye Name: 1-benzyl-5-[[2-(4-methylpiperazin-1-yl)acetyl]amino]triazole-4-carboxamide CAS Name: 5-[[2-(4-methyl-1-piperazinyl)-1-oxoethyl]amino]-1-(phenylmethyl)-4-triazolecarboxamide IUPAC Name: 1-benzyl-5-[[2-(4-methylpiperazin-1-yl)acetyl]amino]triazole-4-carboxamide Traditional Name: 1-benzyl-5-[[2-(4-methylpiperazino)acetyl]amino]triazole-4-carboxamide Formula: C17H23N7O2 MolecularWeight: 357.41022

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC(=O)NC2=C(N=NN2CC3=CC=CC=C3)C(=O)N

Isomeric SMILES

CN1CCN(CC1)CC(=O)NC2=C(N=NN2CC3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C17H23N7O2/c1-22-7-9-23(10-8-22)12-14(25)19-17-15(16(18)26)20-21-24(17)11-13-5-3-2-4-6-13/h2-6H,7-12H2,1H3,(H2,18,26)(H,19,25)