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

Systemtic Name: 2-(3-azanyl-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-[4-(diethylsulfamoyl)phenyl]butanamide Openeye Name: 2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-[4-(diethylsulfamoyl)phenyl]butanamide CAS Name: 2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]-N-[4-(diethylsulfamoyl)phenyl]butanamide IUPAC Name: 2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-[4-(diethylsulfamoyl)phenyl]butanamide Traditional Name: 2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]-N-[4-(diethylsulfamoyl)phenyl]butyramide Formula: C17H26N6O3S2 MolecularWeight: 426.55674

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N(CC)CC)N2C(=NN=C2SC)N

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N(CC)CC)N2C(=NN=C2SC)N

InChI

InChI=1S/C17H26N6O3S2/c1-5-14(23-16(18)20-21-17(23)27-4)15(24)19-12-8-10-13(11-9-12)28(25,26)22(6-2)7-3/h8-11,14H,5-7H2,1-4H3,(H2,18,20)(H,19,24)