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

Systemtic Name: 1-(4-ethoxyphenyl)-N-(2-methyl-1,3-benzothiazol-6-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: 1-(4-ethoxyphenyl)-N-(2-methyl-1,3-benzothiazol-6-yl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: 1-(4-ethoxyphenyl)-N-(2-methyl-1,3-benzothiazol-6-yl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: 1-(4-ethoxyphenyl)-N-(2-methyl-1,3-benzothiazol-6-yl)-5-oxopyrrolidine-3-carboxamide Traditional Name: 5-keto-N-(2-methyl-1,3-benzothiazol-6-yl)-1-p-phenetyl-pyrrolidine-3-carboxamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=CC4=C(C=C3)N=C(S4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=CC4=C(C=C3)N=C(S4)C

InChI

InChI=1S/C21H21N3O3S/c1-3-27-17-7-5-16(6-8-17)24-12-14(10-20(24)25)21(26)23-15-4-9-18-19(11-15)28-13(2)22-18/h4-9,11,14H,3,10,12H2,1-2H3,(H,23,26)