2-(3-azanyl-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-[4-(dimethylsulfamoyl)phenyl]butanamide

Systemtic Name: 2-(3-azanyl-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-[4-(dimethylsulfamoyl)phenyl]butanamide Openeye Name: 2-(3-amino-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-[4-(dimethylsulfamoyl)phenyl]butanamide CAS Name: 2-[3-amino-5-(ethylthio)-1,2,4-triazol-4-yl]-N-[4-(dimethylsulfamoyl)phenyl]butanamide IUPAC Name: 2-(3-amino-5-ethylsulfanyl-1,2,4-triazol-4-yl)-N-[4-(dimethylsulfamoyl)phenyl]butanamide Traditional Name: 2-[3-amino-5-(ethylthio)-1,2,4-triazol-4-yl]-N-[4-(dimethylsulfamoyl)phenyl]butyramide Formula: C16H24N6O3S2 MolecularWeight: 412.53016

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N(C)C)N2C(=NN=C2SCC)N

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N(C)C)N2C(=NN=C2SCC)N

InChI

InChI=1S/C16H24N6O3S2/c1-5-13(22-15(17)19-20-16(22)26-6-2)14(23)18-11-7-9-12(10-8-11)27(24,25)21(3)4/h7-10,13H,5-6H2,1-4H3,(H2,17,19)(H,18,23)