1-[2-[(3-cyano-4,5-dimethyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[(3-cyano-4,5-dimethyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[(3-cyano-4,5-dimethyl-2-thienyl)amino]-2-oxo-ethyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(3-cyano-4,5-dimethyl-2-thiophenyl)amino]-2-oxoethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[(3-cyano-4,5-dimethylthiophen-2-yl)amino]-2-oxoethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(3-cyano-4,5-dimethyl-2-thienyl)amino]-2-keto-ethyl]proline Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)CN2CCCC2C(=O)O)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)CN2CCCC2C(=O)O)C

InChI

InChI=1S/C14H17N3O3S/c1-8-9(2)21-13(10(8)6-15)16-12(18)7-17-5-3-4-11(17)14(19)20/h11H,3-5,7H2,1-2H3,(H,16,18)(H,19,20)