N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazol-5-amine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazol-5-amine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazol-5-amine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazol-5-amine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(4-chlorophenyl)methyl]-1,2,4-thiadiazol-5-amine Traditional Name: [3-(4-chlorobenzyl)-1,2,4-thiadiazol-5-yl]-piperonyl-amine Formula: C17H14ClN3O2S MolecularWeight: 359.82996

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC3=NC(=NS3)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC3=NC(=NS3)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C17H14ClN3O2S/c18-13-4-1-11(2-5-13)8-16-20-17(24-21-16)19-9-12-3-6-14-15(7-12)23-10-22-14/h1-7H,8-10H2,(H,19,20,21)