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

Systemtic Name: N-[3-(3,5-dimethylpyrazol-1-yl)carbonyl-6-propan-2-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[3-(3,5-dimethylpyrazole-1-carbonyl)-6-isopropyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[3-[(3,5-dimethyl-1-pyrazolyl)-oxomethyl]-6-propan-2-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[3-(3,5-dimethylpyrazole-1-carbonyl)-6-propan-2-yl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[3-(3,5-dimethylpyrazole-1-carbonyl)-6-isopropyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl]-4-pyrrolidinosulfonyl-benzamide Formula: C27H33N5O4S2 MolecularWeight: 555.71202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=O)C2=C(SC3=C2CCN(C3)C(C)C)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCC5)C

Isomeric SMILES

CC1=CC(=NN1C(=O)C2=C(SC3=C2CCN(C3)C(C)C)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCC5)C

InChI

InChI=1S/C27H33N5O4S2/c1-17(2)30-14-11-22-23(16-30)37-26(24(22)27(34)32-19(4)15-18(3)29-32)28-25(33)20-7-9-21(10-8-20)38(35,36)31-12-5-6-13-31/h7-10,15,17H,5-6,11-14,16H2,1-4H3,(H,28,33)