5-azanyl-1-[(4-methylsulfanylphenyl)methyl]-N-phenethyl-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-azanyl-1-[(4-methylsulfanylphenyl)methyl]-N-phenethyl-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-1-[(4-methylsulfanylphenyl)methyl]-N-phenethyl-triazole-4-carboxamide CAS Name: 5-amino-1-[[4-(methylthio)phenyl]methyl]-N-phenethyl-4-triazolecarboxamide IUPAC Name: 5-amino-1-[(4-methylsulfanylphenyl)methyl]-N-phenethyltriazole-4-carboxamide Traditional Name: 5-amino-1-[4-(methylthio)benzyl]-N-phenethyl-triazole-4-carboxamide Formula: C19H21N5OS MolecularWeight: 367.46794

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CN2C(=C(N=N2)C(=O)NCCC3=CC=CC=C3)N

Isomeric SMILES

CSC1=CC=C(C=C1)CN2C(=C(N=N2)C(=O)NCCC3=CC=CC=C3)N

InChI

InChI=1S/C19H21N5OS/c1-26-16-9-7-15(8-10-16)13-24-18(20)17(22-23-24)19(25)21-12-11-14-5-3-2-4-6-14/h2-10H,11-13,20H2,1H3,(H,21,25)