3-[3-methyl-2-[[methyl-(phenylmethyl)carbamoyl]amino]butanoyl]-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 3-[3-methyl-2-[[methyl-(phenylmethyl)carbamoyl]amino]butanoyl]-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-[2-[[benzyl(methyl)carbamoyl]amino]-3-methyl-butanoyl]thiazolidine-4-carboxylic acid CAS Name: 3-[3-methyl-2-[[[methyl-(phenylmethyl)amino]-oxomethyl]amino]-1-oxobutyl]-4-thiazolidinecarboxylic acid IUPAC Name: 3-[2-[[benzyl(methyl)carbamoyl]amino]-3-methylbutanoyl]-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-[2-[[benzyl(methyl)carbamoyl]amino]-3-methyl-butanoyl]thiazolidine-4-carboxylic acid Formula: C18H25N3O4S MolecularWeight: 379.4738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CSCC1C(=O)O)NC(=O)N(C)CC2=CC=CC=C2

Isomeric SMILES

CC(C)C(C(=O)N1CSCC1C(=O)O)NC(=O)N(C)CC2=CC=CC=C2

InChI

InChI=1S/C18H25N3O4S/c1-12(2)15(16(22)21-11-26-10-14(21)17(23)24)19-18(25)20(3)9-13-7-5-4-6-8-13/h4-8,12,14-15H,9-11H2,1-3H3,(H,19,25)(H,23,24)