2-(4-chloranylphenoxy)-2-methyl-N-[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide

Systemtic Name: 2-(4-chloranylphenoxy)-2-methyl-N-[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: 2-(4-chlorophenoxy)-2-methyl-N-[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide CAS Name: 2-(4-chlorophenoxy)-2-methyl-N-[5-(3-phenylpropylthio)-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: 2-(4-chlorophenoxy)-2-methyl-N-[5-(3-phenylpropylsulfanyl)-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: 2-(4-chlorophenoxy)-2-methyl-N-[5-(3-phenylpropylthio)-1,3,4-thiadiazol-2-yl]propionamide Formula: C21H22ClN3O2S2 MolecularWeight: 448.00128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1=NN=C(S1)SCCCC2=CC=CC=C2)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C(=O)NC1=NN=C(S1)SCCCC2=CC=CC=C2)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H22ClN3O2S2/c1-21(2,27-17-12-10-16(22)11-13-17)18(26)23-19-24-25-20(29-19)28-14-6-9-15-7-4-3-5-8-15/h3-5,7-8,10-13H,6,9,14H2,1-2H3,(H,23,24,26)