1-[4-[[(5-methyl-4-phenyl-1,3-thiazol-2-yl)-prop-2-enyl-amino]methyl]phenyl]carbonylpyrrolidine-2-carboxylic acid

Systemtic Name: 1-[4-[[(5-methyl-4-phenyl-1,3-thiazol-2-yl)-prop-2-enyl-amino]methyl]phenyl]carbonylpyrrolidine-2-carboxylic acid Openeye Name: 1-[4-[[allyl-(5-methyl-4-phenyl-thiazol-2-yl)amino]methyl]benzoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[[4-[[(5-methyl-4-phenyl-2-thiazolyl)-prop-2-enylamino]methyl]phenyl]-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[4-[[(5-methyl-4-phenyl-1,3-thiazol-2-yl)-prop-2-enylamino]methyl]benzoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[4-[[allyl-(5-methyl-4-phenyl-thiazol-2-yl)amino]methyl]benzoyl]proline Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(S1)N(CC=C)CC2=CC=C(C=C2)C(=O)N3CCCC3C(=O)O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C(S1)N(CC=C)CC2=CC=C(C=C2)C(=O)N3CCCC3C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C26H27N3O3S/c1-3-15-28(26-27-23(18(2)33-26)20-8-5-4-6-9-20)17-19-11-13-21(14-12-19)24(30)29-16-7-10-22(29)25(31)32/h3-6,8-9,11-14,22H,1,7,10,15-17H2,2H3,(H,31,32)