N-[3-(1,3-benzothiazol-2-yl)propyl]-5-oxidanylidene-1-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-5-oxidanylidene-1-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-5-oxo-1-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-5-oxo-1-(3,4,5-trimethoxyphenyl)-3-pyrrolidinecarboxamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-5-oxo-1-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)propyl]-5-keto-1-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide Formula: C24H27N3O5S MolecularWeight: 469.55328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)N2CC(CC2=O)C(=O)NCCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)N2CC(CC2=O)C(=O)NCCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C24H27N3O5S/c1-30-18-12-16(13-19(31-2)23(18)32-3)27-14-15(11-22(27)28)24(29)25-10-6-9-21-26-17-7-4-5-8-20(17)33-21/h4-5,7-8,12-13,15H,6,9-11,14H2,1-3H3,(H,25,29)