N-[3-(1,3-benzothiazol-2-yl)-6-ethanoyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-1-thiophen-2-ylsulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)-6-ethanoyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-1-thiophen-2-ylsulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-[6-acetyl-3-(1,3-benzothiazol-2-yl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-1-(2-thienylsulfonyl)pyrrolidine-2-carboxamide CAS Name: N-[6-acetyl-3-(1,3-benzothiazol-2-yl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-1-thiophen-2-ylsulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-[6-acetyl-3-(1,3-benzothiazol-2-yl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-1-thiophen-2-ylsulfonylpyrrolidine-2-carboxamide Traditional Name: N-[6-acetyl-3-(1,3-benzothiazol-2-yl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-1-(2-thienylsulfonyl)pyrrolidine-2-carboxamide Formula: C25H24N4O4S4 MolecularWeight: 572.74246

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=C(C1)SC(=C2C3=NC4=CC=CC=C4S3)NC(=O)C5CCCN5S(=O)(=O)C6=CC=CS6

Isomeric SMILES

CC(=O)N1CCC2=C(C1)SC(=C2C3=NC4=CC=CC=C4S3)NC(=O)C5CCCN5S(=O)(=O)C6=CC=CS6

InChI

InChI=1S/C25H24N4O4S4/c1-15(30)28-12-10-16-20(14-28)36-25(22(16)24-26-17-6-2-3-8-19(17)35-24)27-23(31)18-7-4-11-29(18)37(32,33)21-9-5-13-34-21/h2-3,5-6,8-9,13,18H,4,7,10-12,14H2,1H3,(H,27,31)