3-(4-methyl-2-phenylazanyl-pentanethioyl)imidazolidine-4-carboxylic acid

Systemtic Name: 3-(4-methyl-2-phenylazanyl-pentanethioyl)imidazolidine-4-carboxylic acid Openeye Name: 3-(2-anilino-4-methyl-pentanethioyl)imidazolidine-4-carboxylic acid CAS Name: 3-(2-anilino-4-methyl-1-sulfanylidenepentyl)-4-imidazolidinecarboxylic acid IUPAC Name: 3-(2-anilino-4-methylpentanethioyl)imidazolidine-4-carboxylic acid Traditional Name: 3-(2-anilino-4-methyl-pentanethioyl)imidazolidine-4-carboxylic acid Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=S)N1CNCC1C(=O)O)NC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C(=S)N1CNCC1C(=O)O)NC2=CC=CC=C2

InChI

InChI=1S/C16H23N3O2S/c1-11(2)8-13(18-12-6-4-3-5-7-12)15(22)19-10-17-9-14(19)16(20)21/h3-7,11,13-14,17-18H,8-10H2,1-2H3,(H,20,21)