3-methylsulfanyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]propanamide

Systemtic Name: 3-methylsulfanyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]propanamide Openeye Name: 3-methylsulfanyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]propanamide CAS Name: 3-(methylthio)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]propanamide IUPAC Name: 3-methylsulfanyl-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]propanamide Traditional Name: 3-(methylthio)-N-[4-(1,2,4-triazol-1-ylmethyl)benzyl]propionamide Formula: C14H18N4OS MolecularWeight: 290.38392

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(=O)NCC1=CC=C(C=C1)CN2C=NC=N2

Isomeric SMILES

CSCCC(=O)NCC1=CC=C(C=C1)CN2C=NC=N2

InChI

InChI=1S/C14H18N4OS/c1-20-7-6-14(19)16-8-12-2-4-13(5-3-12)9-18-11-15-10-17-18/h2-5,10-11H,6-9H2,1H3,(H,16,19)