N-[3-(1,3-benzothiazol-2-yl)-6-propyl-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-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-1-thiophen-2-ylsulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)-6-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-1-(2-thienylsulfonyl)pyrrolidine-2-carboxamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)-6-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-1-thiophen-2-ylsulfonyl-2-pyrrolidinecarboxamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)-6-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-1-thiophen-2-ylsulfonylpyrrolidine-2-carboxamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)-6-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-1-(2-thienylsulfonyl)pyrrolidine-2-carboxamide Formula: C26H28N4O3S4 MolecularWeight: 572.78552

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCC2=C(C1)SC(=C2C3=NC4=CC=CC=C4S3)NC(=O)C5CCCN5S(=O)(=O)C6=CC=CS6

Isomeric SMILES

CCCN1CCC2=C(C1)SC(=C2C3=NC4=CC=CC=C4S3)NC(=O)C5CCCN5S(=O)(=O)C6=CC=CS6

InChI

InChI=1S/C26H28N4O3S4/c1-2-12-29-14-11-17-21(16-29)36-26(23(17)25-27-18-7-3-4-9-20(18)35-25)28-24(31)19-8-5-13-30(19)37(32,33)22-10-6-15-34-22/h3-4,6-7,9-10,15,19H,2,5,8,11-14,16H2,1H3,(H,28,31)