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

Systemtic Name: 2-(3,4-dimethylphenoxy)-N-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: 2-(3,4-dimethylphenoxy)-N-[5-(1-naphthylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide CAS Name: 2-(3,4-dimethylphenoxy)-N-[5-(1-naphthalenylmethylthio)-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: 2-(3,4-dimethylphenoxy)-N-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: 2-(3,4-dimethylphenoxy)-N-[5-(1-naphthylmethylthio)-1,3,4-thiadiazol-2-yl]propionamide Formula: C24H23N3O2S2 MolecularWeight: 449.58832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OC(C)C(=O)NC2=NN=C(S2)SCC3=CC=CC4=CC=CC=C43)C

Isomeric SMILES

CC1=C(C=C(C=C1)OC(C)C(=O)NC2=NN=C(S2)SCC3=CC=CC4=CC=CC=C43)C

InChI

InChI=1S/C24H23N3O2S2/c1-15-11-12-20(13-16(15)2)29-17(3)22(28)25-23-26-27-24(31-23)30-14-19-9-6-8-18-7-4-5-10-21(18)19/h4-13,17H,14H2,1-3H3,(H,25,26,28)