(2S)-2-(aminocarbonylamino)-N-[3-(diethylsulfamoyl)-4-methyl-phenyl]-4-methylsulfanyl-butanamide

Systemtic Name: (2S)-2-(aminocarbonylamino)-N-[3-(diethylsulfamoyl)-4-methyl-phenyl]-4-methylsulfanyl-butanamide Openeye Name: (2S)-N-[3-(diethylsulfamoyl)-4-methyl-phenyl]-4-methylsulfanyl-2-ureido-butanamide CAS Name: (2S)-2-(carbamoylamino)-N-[3-(diethylsulfamoyl)-4-methylphenyl]-4-(methylthio)butanamide IUPAC Name: (2S)-2-(carbamoylamino)-N-[3-(diethylsulfamoyl)-4-methylphenyl]-4-methylsulfanylbutanamide Traditional Name: (2S)-N-[3-(diethylsulfamoyl)-4-methyl-phenyl]-4-(methylthio)-2-ureido-butyramide Formula: C17H28N4O4S2 MolecularWeight: 416.55862

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)NC(=O)C(CCSC)NC(=O)N)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)NC(=O)[C@H](CCSC)NC(=O)N)C

InChI

InChI=1S/C17H28N4O4S2/c1-5-21(6-2)27(24,25)15-11-13(8-7-12(15)3)19-16(22)14(9-10-26-4)20-17(18)23/h7-8,11,14H,5-6,9-10H2,1-4H3,(H,19,22)(H3,18,20,23)/t14-/m0/s1