2-azanyl-3-[1-(3-chloranyl-2-methyl-phenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-3-methyl-butanoic acid

Systemtic Name: 2-azanyl-3-[1-(3-chloranyl-2-methyl-phenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-yl]sulfanyl-3-methyl-butanoic acid Openeye Name: 2-amino-3-[1-(3-chloro-2-methyl-phenyl)-2,5-dioxo-pyrrolidin-3-yl]sulfanyl-3-methyl-butanoic acid CAS Name: 2-amino-3-[[1-(3-chloro-2-methylphenyl)-2,5-dioxo-3-pyrrolidinyl]thio]-3-methylbutanoic acid IUPAC Name: 2-amino-3-[1-(3-chloro-2-methylphenyl)-2,5-dioxopyrrolidin-3-yl]sulfanyl-3-methylbutanoic acid Traditional Name: 2-amino-3-[[1-(3-chloro-2-methyl-phenyl)-2,5-diketo-pyrrolidin-3-yl]thio]-3-methyl-butyric acid Formula: C16H19ClN2O4S MolecularWeight: 370.85106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N2C(=O)CC(C2=O)SC(C)(C)C(C(=O)O)N

Isomeric SMILES

CC1=C(C=CC=C1Cl)N2C(=O)CC(C2=O)SC(C)(C)C(C(=O)O)N

InChI

InChI=1S/C16H19ClN2O4S/c1-8-9(17)5-4-6-10(8)19-12(20)7-11(14(19)21)24-16(2,3)13(18)15(22)23/h4-6,11,13H,7,18H2,1-3H3,(H,22,23)