3-(3,4-dimethylphenyl)sulfanyl-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)propanamide

Systemtic Name: 3-(3,4-dimethylphenyl)sulfanyl-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)propanamide Openeye Name: 3-(3,4-dimethylphenyl)sulfanyl-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)propanamide CAS Name: 3-[(3,4-dimethylphenyl)thio]-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)propanamide IUPAC Name: 3-(3,4-dimethylphenyl)sulfanyl-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)propanamide Traditional Name: 3-[(3,4-dimethylphenyl)thio]-N-(5-isopropyl-1,3,4-thiadiazol-2-yl)propionamide Formula: C16H21N3OS2 MolecularWeight: 335.48744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCC(=O)NC2=NN=C(S2)C(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCC(=O)NC2=NN=C(S2)C(C)C)C

InChI

InChI=1S/C16H21N3OS2/c1-10(2)15-18-19-16(22-15)17-14(20)7-8-21-13-6-5-11(3)12(4)9-13/h5-6,9-10H,7-8H2,1-4H3,(H,17,19,20)