N-[4-(2-oxidanylidenechromen-3-yl)-1,3-thiazol-2-yl]-1-thiophen-2-ylsulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[4-(2-oxidanylidenechromen-3-yl)-1,3-thiazol-2-yl]-1-thiophen-2-ylsulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-[4-(2-oxochromen-3-yl)thiazol-2-yl]-1-(2-thienylsulfonyl)pyrrolidine-2-carboxamide CAS Name: N-[4-(2-oxo-1-benzopyran-3-yl)-2-thiazolyl]-1-thiophen-2-ylsulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-[4-(2-oxochromen-3-yl)-1,3-thiazol-2-yl]-1-thiophen-2-ylsulfonylpyrrolidine-2-carboxamide Traditional Name: N-[4-(2-ketochromen-3-yl)thiazol-2-yl]-1-(2-thienylsulfonyl)pyrrolidine-2-carboxamide Formula: C21H17N3O5S3 MolecularWeight: 487.57178

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=CS2)C(=O)NC3=NC(=CS3)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=CS2)C(=O)NC3=NC(=CS3)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C21H17N3O5S3/c25-19(16-6-3-9-24(16)32(27,28)18-8-4-10-30-18)23-21-22-15(12-31-21)14-11-13-5-1-2-7-17(13)29-20(14)26/h1-2,4-5,7-8,10-12,16H,3,6,9H2,(H,22,23,25)