N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-5-oxidanylidene-1-(phenylmethyl)pyrrolidine-3-carboxamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-5-oxidanylidene-1-(phenylmethyl)pyrrolidine-3-carboxamide Openeye Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-1-benzyl-5-oxo-pyrrolidine-3-carboxamide CAS Name: N-[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]-5-oxo-1-(phenylmethyl)-3-pyrrolidinecarboxamide IUPAC Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-1-benzyl-5-oxopyrrolidine-3-carboxamide Traditional Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-1-benzyl-5-keto-pyrrolidine-3-carboxamide Formula: C22H19N3O4S MolecularWeight: 421.46896

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)CC2=CC=CC=C2)C(=O)NC3=NC(=CS3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1C(CN(C1=O)CC2=CC=CC=C2)C(=O)NC3=NC(=CS3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H19N3O4S/c26-20-9-16(11-25(20)10-14-4-2-1-3-5-14)21(27)24-22-23-17(12-30-22)15-6-7-18-19(8-15)29-13-28-18/h1-8,12,16H,9-11,13H2,(H,23,24,27)