N-[3-(acetamidocarbamoyl)-6-(phenylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[3-(acetamidocarbamoyl)-6-(phenylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[3-(acetamidocarbamoyl)-6-benzyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[3-[(acetylhydrazo)-oxomethyl]-6-(phenylmethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[3-(acetamidocarbamoyl)-6-benzyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[3-(acetamidocarbamoyl)-6-benzyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-4-pyrrolidinosulfonyl-benzamide Formula: C28H31N5O5S2 MolecularWeight: 581.70624

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NNC(=O)C1=C(SC2=C1CCN(C2)CC3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCC5

Isomeric SMILES

CC(=O)NNC(=O)C1=C(SC2=C1CCN(C2)CC3=CC=CC=C3)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C28H31N5O5S2/c1-19(34)30-31-27(36)25-23-13-16-32(17-20-7-3-2-4-8-20)18-24(23)39-28(25)29-26(35)21-9-11-22(12-10-21)40(37,38)33-14-5-6-15-33/h2-4,7-12H,5-6,13-18H2,1H3,(H,29,35)(H,30,34)(H,31,36)