1-[2-[(5-bromanylthiophen-2-yl)methyl-ethyl-amino]-2-oxidanylidene-ethyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[(5-bromanylthiophen-2-yl)methyl-ethyl-amino]-2-oxidanylidene-ethyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[(5-bromo-2-thienyl)methyl-ethyl-amino]-2-oxo-ethyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(5-bromo-2-thiophenyl)methyl-ethylamino]-2-oxoethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[(5-bromothiophen-2-yl)methyl-ethylamino]-2-oxoethyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[(5-bromo-2-thienyl)methyl-ethyl-amino]-2-keto-ethyl]proline Formula: C14H19BrN2O3S MolecularWeight: 375.28126

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(S1)Br)C(=O)CN2CCCC2C(=O)O

Isomeric SMILES

CCN(CC1=CC=C(S1)Br)C(=O)CN2CCCC2C(=O)O

InChI

InChI=1S/C14H19BrN2O3S/c1-2-16(8-10-5-6-12(15)21-10)13(18)9-17-7-3-4-11(17)14(19)20/h5-6,11H,2-4,7-9H2,1H3,(H,19,20)