N-[3-(3,5-dimethylpyrazol-1-yl)carbonyl-6-ethanoyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-4-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[3-(3,5-dimethylpyrazol-1-yl)carbonyl-6-ethanoyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[6-acetyl-3-(3,5-dimethylpyrazole-1-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-4-(1-piperidylsulfonyl)benzamide CAS Name: N-[6-acetyl-3-[(3,5-dimethyl-1-pyrazolyl)-oxomethyl]-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[6-acetyl-3-(3,5-dimethylpyrazole-1-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[6-acetyl-3-(3,5-dimethylpyrazole-1-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-4-piperidinosulfonyl-benzamide Formula: C27H31N5O5S2 MolecularWeight: 569.69554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=O)C2=C(SC3=C2CCN(C3)C(=O)C)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5)C

Isomeric SMILES

CC1=CC(=NN1C(=O)C2=C(SC3=C2CCN(C3)C(=O)C)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCCC5)C

InChI

InChI=1S/C27H31N5O5S2/c1-17-15-18(2)32(29-17)27(35)24-22-11-14-30(19(3)33)16-23(22)38-26(24)28-25(34)20-7-9-21(10-8-20)39(36,37)31-12-5-4-6-13-31/h7-10,15H,4-6,11-14,16H2,1-3H3,(H,28,34)