2-(3,4-dimethoxyphenyl)-N-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]ethanamide

Systemtic Name: 2-(3,4-dimethoxyphenyl)-N-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]ethanamide Openeye Name: 2-(3,4-dimethoxyphenyl)-N-[5-(1-naphthylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]acetamide CAS Name: 2-(3,4-dimethoxyphenyl)-N-[5-(1-naphthalenylmethylthio)-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: 2-(3,4-dimethoxyphenyl)-N-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]acetamide Traditional Name: 2-(3,4-dimethoxyphenyl)-N-[5-(1-naphthylmethylthio)-1,3,4-thiadiazol-2-yl]acetamide Formula: C23H21N3O3S2 MolecularWeight: 451.56114

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)NC2=NN=C(S2)SCC3=CC=CC4=CC=CC=C43)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)NC2=NN=C(S2)SCC3=CC=CC4=CC=CC=C43)OC

InChI

InChI=1S/C23H21N3O3S2/c1-28-19-11-10-15(12-20(19)29-2)13-21(27)24-22-25-26-23(31-22)30-14-17-8-5-7-16-6-3-4-9-18(16)17/h3-12H,13-14H2,1-2H3,(H,24,25,27)