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

Systemtic Name: N-[2-[4-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[4-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[4-(4-methoxyphenyl)-5-(methylthio)-1,2,4-triazol-3-yl]ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[4-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]ethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[4-(4-methoxyphenyl)-5-(methylthio)-1,2,4-triazol-3-yl]ethyl]-piperonylamide Formula: C20H20N4O4S MolecularWeight: 412.4622

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=NN=C2SC)CCNC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=NN=C2SC)CCNC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H20N4O4S/c1-26-15-6-4-14(5-7-15)24-18(22-23-20(24)29-2)9-10-21-19(25)13-3-8-16-17(11-13)28-12-27-16/h3-8,11H,9-10,12H2,1-2H3,(H,21,25)