N-[2-(4-ethyl-5-methylsulfanyl-1,2,4-triazol-3-yl)ethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-(4-ethyl-5-methylsulfanyl-1,2,4-triazol-3-yl)ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-(4-ethyl-5-methylsulfanyl-1,2,4-triazol-3-yl)ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[4-ethyl-5-(methylthio)-1,2,4-triazol-3-yl]ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-(4-ethyl-5-methylsulfanyl-1,2,4-triazol-3-yl)ethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[4-ethyl-5-(methylthio)-1,2,4-triazol-3-yl]ethyl]-piperonylamide Formula: C15H18N4O3S MolecularWeight: 334.39342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC)CCNC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCN1C(=NN=C1SC)CCNC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H18N4O3S/c1-3-19-13(17-18-15(19)23-2)6-7-16-14(20)10-4-5-11-12(8-10)22-9-21-11/h4-5,8H,3,6-7,9H2,1-2H3,(H,16,20)