(2S)-N-(4-acetamidophenyl)-2-(aminocarbonylamino)-4-methylsulfanyl-butanamide

Systemtic Name: (2S)-N-(4-acetamidophenyl)-2-(aminocarbonylamino)-4-methylsulfanyl-butanamide Openeye Name: (2S)-N-(4-acetamidophenyl)-4-methylsulfanyl-2-ureido-butanamide CAS Name: (2S)-N-(4-acetamidophenyl)-2-(carbamoylamino)-4-(methylthio)butanamide IUPAC Name: (2S)-N-(4-acetamidophenyl)-2-(carbamoylamino)-4-methylsulfanylbutanamide Traditional Name: (2S)-N-(4-acetamidophenyl)-4-(methylthio)-2-ureido-butyramide Formula: C14H20N4O3S MolecularWeight: 324.3986

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)C(CCSC)NC(=O)N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)[C@H](CCSC)NC(=O)N

InChI

InChI=1S/C14H20N4O3S/c1-9(19)16-10-3-5-11(6-4-10)17-13(20)12(7-8-22-2)18-14(15)21/h3-6,12H,7-8H2,1-2H3,(H,16,19)(H,17,20)(H3,15,18,21)/t12-/m0/s1