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

Systemtic Name: N-[2-[4-methyl-5-(2-methylpropylsulfanyl)-1,2,4-triazol-3-yl]ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-(5-isobutylsulfanyl-4-methyl-1,2,4-triazol-3-yl)ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[4-methyl-5-(2-methylpropylthio)-1,2,4-triazol-3-yl]ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[4-methyl-5-(2-methylpropylsulfanyl)-1,2,4-triazol-3-yl]ethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[5-(isobutylthio)-4-methyl-1,2,4-triazol-3-yl]ethyl]-piperonylamide Formula: C17H22N4O3S MolecularWeight: 362.44658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NN=C(N1C)CCNC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)CSC1=NN=C(N1C)CCNC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C17H22N4O3S/c1-11(2)9-25-17-20-19-15(21(17)3)6-7-18-16(22)12-4-5-13-14(8-12)24-10-23-13/h4-5,8,11H,6-7,9-10H2,1-3H3,(H,18,22)