2-[(3-chlorophenyl)carbamoylamino]-3-methyl-3-sulfanyl-butanoic acid

Systemtic Name: 2-[(3-chlorophenyl)carbamoylamino]-3-methyl-3-sulfanyl-butanoic acid Openeye Name: 2-[(3-chlorophenyl)carbamoylamino]-3-methyl-3-sulfanyl-butanoic acid CAS Name: 2-[[(3-chloroanilino)-oxomethyl]amino]-3-mercapto-3-methylbutanoic acid IUPAC Name: 2-[(3-chlorophenyl)carbamoylamino]-3-methyl-3-sulfanylbutanoic acid Traditional Name: 2-[(3-chlorophenyl)carbamoylamino]-3-mercapto-3-methyl-butyric acid Formula: C12H15ClN2O3S MolecularWeight: 302.7771

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C(=O)O)NC(=O)NC1=CC(=CC=C1)Cl)S

Isomeric SMILES

CC(C)(C(C(=O)O)NC(=O)NC1=CC(=CC=C1)Cl)S

InChI

InChI=1S/C12H15ClN2O3S/c1-12(2,19)9(10(16)17)15-11(18)14-8-5-3-4-7(13)6-8/h3-6,9,19H,1-2H3,(H,16,17)(H2,14,15,18)