3-(3,4-dimethylphenyl)sulfanyl-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]propanamide

Systemtic Name: 3-(3,4-dimethylphenyl)sulfanyl-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)sulfanyl-propanamide CAS Name: 3-[(3,4-dimethylphenyl)thio]-N-[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-3-(3,4-dimethylphenyl)sulfanylpropanamide Traditional Name: N-(5-benzyl-1,3,4-thiadiazol-2-yl)-3-[(3,4-dimethylphenyl)thio]propionamide Formula: C20H21N3OS2 MolecularWeight: 383.53024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCC(=O)NC2=NN=C(S2)CC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCC(=O)NC2=NN=C(S2)CC3=CC=CC=C3)C

InChI

InChI=1S/C20H21N3OS2/c1-14-8-9-17(12-15(14)2)25-11-10-18(24)21-20-23-22-19(26-20)13-16-6-4-3-5-7-16/h3-9,12H,10-11,13H2,1-2H3,(H,21,23,24)