(2S)-2-(aminocarbonylamino)-N-[2-(4-chlorophenyl)sulfanylethyl]-3-methyl-butanamide

Systemtic Name: (2S)-2-(aminocarbonylamino)-N-[2-(4-chlorophenyl)sulfanylethyl]-3-methyl-butanamide Openeye Name: (2S)-N-[2-(4-chlorophenyl)sulfanylethyl]-3-methyl-2-ureido-butanamide CAS Name: (2S)-2-(carbamoylamino)-N-[2-[(4-chlorophenyl)thio]ethyl]-3-methylbutanamide IUPAC Name: (2S)-2-(carbamoylamino)-N-[2-(4-chlorophenyl)sulfanylethyl]-3-methylbutanamide Traditional Name: (2S)-N-[2-[(4-chlorophenyl)thio]ethyl]-3-methyl-2-ureido-butyramide Formula: C14H20ClN3O2S MolecularWeight: 329.8455

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCSC1=CC=C(C=C1)Cl)NC(=O)N

Isomeric SMILES

CC(C)[C@@H](C(=O)NCCSC1=CC=C(C=C1)Cl)NC(=O)N

InChI

InChI=1S/C14H20ClN3O2S/c1-9(2)12(18-14(16)20)13(19)17-7-8-21-11-5-3-10(15)4-6-11/h3-6,9,12H,7-8H2,1-2H3,(H,17,19)(H3,16,18,20)/t12-/m0/s1