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

Systemtic Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-5-oxidanylidene-1-phenethyl-pyrrolidine-3-carboxamide Openeye Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-5-oxo-1-phenethyl-pyrrolidine-3-carboxamide CAS Name: N-[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]-5-oxo-1-phenethyl-3-pyrrolidinecarboxamide IUPAC Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-5-oxo-1-phenethylpyrrolidine-3-carboxamide Traditional Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-5-keto-1-phenethyl-pyrrolidine-3-carboxamide Formula: C23H21N3O4S MolecularWeight: 435.49554

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C1=O)CCC2=CC=CC=C2)C(=O)NC3=NC(=CS3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1C(CN(C1=O)CCC2=CC=CC=C2)C(=O)NC3=NC(=CS3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H21N3O4S/c27-21-11-17(12-26(21)9-8-15-4-2-1-3-5-15)22(28)25-23-24-18(13-31-23)16-6-7-19-20(10-16)30-14-29-19/h1-7,10,13,17H,8-9,11-12,14H2,(H,24,25,28)