N-[(4-cyclopropyl-5-methylsulfanyl-1,2,4-triazol-3-yl)methyl]aniline

Systemtic Name: N-[(4-cyclopropyl-5-methylsulfanyl-1,2,4-triazol-3-yl)methyl]aniline Openeye Name: N-[(4-cyclopropyl-5-methylsulfanyl-1,2,4-triazol-3-yl)methyl]aniline CAS Name: N-[[4-cyclopropyl-5-(methylthio)-1,2,4-triazol-3-yl]methyl]aniline IUPAC Name: N-[(4-cyclopropyl-5-methylsulfanyl-1,2,4-triazol-3-yl)methyl]aniline Traditional Name: [4-cyclopropyl-5-(methylthio)-1,2,4-triazol-3-yl]methyl-phenyl-amine Formula: C13H16N4S MolecularWeight: 260.35794

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1C2CC2)CNC3=CC=CC=C3

Isomeric SMILES

CSC1=NN=C(N1C2CC2)CNC3=CC=CC=C3

InChI

InChI=1S/C13H16N4S/c1-18-13-16-15-12(17(13)11-7-8-11)9-14-10-5-3-2-4-6-10/h2-6,11,14H,7-9H2,1H3