5-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]ethanoylamino]-2-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]ethanoylamino]-2-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: 5-[[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]acetyl]amino]-2-phenyl-triazole-4-carboxamide CAS Name: 5-[[2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1-oxoethyl]amino]-2-phenyl-4-triazolecarboxamide IUPAC Name: 5-[[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]acetyl]amino]-2-phenyltriazole-4-carboxamide Traditional Name: 2-phenyl-5-[[2-(4-piperonylpiperazino)acetyl]amino]triazole-4-carboxamide Formula: C23H25N7O4 MolecularWeight: 463.4891

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=NN(N=C4C(=O)N)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=NN(N=C4C(=O)N)C5=CC=CC=C5

InChI

InChI=1S/C23H25N7O4/c24-22(32)21-23(27-30(26-21)17-4-2-1-3-5-17)25-20(31)14-29-10-8-28(9-11-29)13-16-6-7-18-19(12-16)34-15-33-18/h1-7,12H,8-11,13-15H2,(H2,24,32)(H,25,27,31)