(3R)-1-(4-ethoxyphenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-5-oxidanylidene-N-(phenylmethyl)pyrrolidine-3-carboxamide

Systemtic Name: (3R)-1-(4-ethoxyphenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-5-oxidanylidene-N-(phenylmethyl)pyrrolidine-3-carboxamide Openeye Name: (3R)-N-benzyl-1-(4-ethoxyphenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3R)-1-(4-ethoxyphenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-5-oxo-N-(phenylmethyl)-3-pyrrolidinecarboxamide IUPAC Name: (3R)-N-benzyl-1-(4-ethoxyphenyl)-N-(6-methyl-1,3-benzothiazol-2-yl)-5-oxopyrrolidine-3-carboxamide Traditional Name: (3R)-N-benzyl-5-keto-N-(6-methyl-1,3-benzothiazol-2-yl)-1-p-phenetyl-pyrrolidine-3-carboxamide Formula: C28H27N3O3S MolecularWeight: 485.59728

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2CC(CC2=O)C(=O)N(CC3=CC=CC=C3)C4=NC5=C(S4)C=C(C=C5)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C[C@@H](CC2=O)C(=O)N(CC3=CC=CC=C3)C4=NC5=C(S4)C=C(C=C5)C

InChI

InChI=1S/C28H27N3O3S/c1-3-34-23-12-10-22(11-13-23)30-18-21(16-26(30)32)27(33)31(17-20-7-5-4-6-8-20)28-29-24-14-9-19(2)15-25(24)35-28/h4-15,21H,3,16-18H2,1-2H3/t21-/m1/s1