1-(azepan-1-yl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-(azepan-1-yl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanone Openeye Name: 1-(azepan-1-yl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanone CAS Name: 1-(1-azepanyl)-2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]ethanone IUPAC Name: 1-(azepan-1-yl)-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanone Traditional Name: 1-(azepan-1-yl)-2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]ethanone Formula: C16H21N3OS2 MolecularWeight: 335.48744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC=N2)SCC(=O)N3CCCCCC3)C

Isomeric SMILES

CC1=C(SC2=C1C(=NC=N2)SCC(=O)N3CCCCCC3)C

InChI

InChI=1S/C16H21N3OS2/c1-11-12(2)22-16-14(11)15(17-10-18-16)21-9-13(20)19-7-5-3-4-6-8-19/h10H,3-9H2,1-2H3