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

Systemtic Name: 2-(4-chloranylphenoxy)-2-methyl-N-[5-(3-phenylpropyl)-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: 2-(4-chlorophenoxy)-2-methyl-N-[5-(3-phenylpropyl)-1,3,4-thiadiazol-2-yl]propanamide CAS Name: 2-(4-chlorophenoxy)-2-methyl-N-[5-(3-phenylpropyl)-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: 2-(4-chlorophenoxy)-2-methyl-N-[5-(3-phenylpropyl)-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: 2-(4-chlorophenoxy)-2-methyl-N-[5-(3-phenylpropyl)-1,3,4-thiadiazol-2-yl]propionamide Formula: C21H22ClN3O2S MolecularWeight: 415.93628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1=NN=C(S1)CCCC2=CC=CC=C2)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C(=O)NC1=NN=C(S1)CCCC2=CC=CC=C2)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H22ClN3O2S/c1-21(2,27-17-13-11-16(22)12-14-17)19(26)23-20-25-24-18(28-20)10-6-9-15-7-4-3-5-8-15/h3-5,7-8,11-14H,6,9-10H2,1-2H3,(H,23,25,26)