N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-methyl-4-(1H-1,2,4-triazol-5-ylsulfanylmethyl)benzamide Traditional Name: N-methyl-N-piperonyl-4-[(1H-1,2,4-triazol-5-ylthio)methyl]benzamide Formula: C19H18N4O3S MolecularWeight: 382.43622

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCO2)C(=O)C3=CC=C(C=C3)CSC4=NC=NN4

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCO2)C(=O)C3=CC=C(C=C3)CSC4=NC=NN4

InChI

InChI=1S/C19H18N4O3S/c1-23(9-14-4-7-16-17(8-14)26-12-25-16)18(24)15-5-2-13(3-6-15)10-27-19-20-11-21-22-19/h2-8,11H,9-10,12H2,1H3,(H,20,21,22)