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

Systemtic Name: 2-(4-chloranyl-3-methyl-phenoxy)-N-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: 2-(4-chloro-3-methyl-phenoxy)-N-[5-(1-naphthylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide CAS Name: 2-(4-chloro-3-methylphenoxy)-N-[5-(1-naphthalenylmethylthio)-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: 2-(4-chloro-3-methylphenoxy)-N-[5-(naphthalen-1-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: 2-(4-chloro-3-methyl-phenoxy)-N-[5-(1-naphthylmethylthio)-1,3,4-thiadiazol-2-yl]propionamide Formula: C23H20ClN3O2S2 MolecularWeight: 470.0068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20ClN3O2S2/c1-14-12-18(10-11-20(14)24)29-15(2)21(28)25-22-26-27-23(31-22)30-13-17-8-5-7-16-6-3-4-9-19(16)17/h3-12,15H,13H2,1-2H3,(H,25,26,28)