N-[3-(azepan-1-yl)propyl]-2-(6-methyl-4-oxidanylidene-5-piperidin-1-ylsulfonyl-thieno[2,3-d]pyrimidin-3-yl)ethanamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-2-(6-methyl-4-oxidanylidene-5-piperidin-1-ylsulfonyl-thieno[2,3-d]pyrimidin-3-yl)ethanamide Openeye Name: N-[3-(azepan-1-yl)propyl]-2-[6-methyl-4-oxo-5-(1-piperidylsulfonyl)thieno[2,3-d]pyrimidin-3-yl]acetamide CAS Name: N-[3-(1-azepanyl)propyl]-2-[6-methyl-4-oxo-5-(1-piperidinylsulfonyl)-3-thieno[2,3-d]pyrimidinyl]acetamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-2-(6-methyl-4-oxo-5-piperidin-1-ylsulfonylthieno[2,3-d]pyrimidin-3-yl)acetamide Traditional Name: N-[3-(azepan-1-yl)propyl]-2-(4-keto-6-methyl-5-piperidinosulfonyl-thieno[2,3-d]pyrimidin-3-yl)acetamide Formula: C23H35N5O4S2 MolecularWeight: 509.6851

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=CN(C2=O)CC(=O)NCCCN3CCCCCC3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C(C2=C(S1)N=CN(C2=O)CC(=O)NCCCN3CCCCCC3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C23H35N5O4S2/c1-18-21(34(31,32)28-14-7-4-8-15-28)20-22(33-18)25-17-27(23(20)30)16-19(29)24-10-9-13-26-11-5-2-3-6-12-26/h17H,2-16H2,1H3,(H,24,29)