3-[2-(azepan-1-ylsulfonyl)ethyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[2-(azepan-1-ylsulfonyl)ethyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-[2-(azepan-1-ylsulfonyl)ethyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-[2-(1-azepanylsulfonyl)ethyl]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-[2-(azepan-1-ylsulfonyl)ethyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-[2-(azepan-1-ylsulfonyl)ethyl]thieno[2,3-d]pyrimidin-4-one Formula: C14H19N3O3S2 MolecularWeight: 341.44896

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)CCN2C=NC3=C(C2=O)C=CS3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)CCN2C=NC3=C(C2=O)C=CS3

InChI

InChI=1S/C14H19N3O3S2/c18-14-12-5-9-21-13(12)15-11-16(14)8-10-22(19,20)17-6-3-1-2-4-7-17/h5,9,11H,1-4,6-8,10H2