3-[4-cyclopropyl-5-[(4-methylsulfanylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[4-cyclopropyl-5-[(4-methylsulfanylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-cyclopropyl-5-[(4-methylsulfanylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-cyclopropyl-5-[[4-(methylthio)phenyl]methylthio]-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-cyclopropyl-5-[(4-methylsulfanylphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[4-cyclopropyl-5-[[4-(methylthio)benzyl]thio]-1,2,4-triazol-3-yl]propionamide Formula: C16H20N4OS2 MolecularWeight: 348.4862

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CSC2=NN=C(N2C3CC3)CCC(=O)N

Isomeric SMILES

CSC1=CC=C(C=C1)CSC2=NN=C(N2C3CC3)CCC(=O)N

InChI

InChI=1S/C16H20N4OS2/c1-22-13-6-2-11(3-7-13)10-23-16-19-18-15(9-8-14(17)21)20(16)12-4-5-12/h2-3,6-7,12H,4-5,8-10H2,1H3,(H2,17,21)