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

Systemtic Name: 1-(azepan-1-yl)-2-(5,6-dimethyl-2-propyl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanone Openeye Name: 1-(azepan-1-yl)-2-(5,6-dimethyl-2-propyl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-ethanone CAS Name: 1-(1-azepanyl)-2-[(5,6-dimethyl-2-propyl-4-thieno[2,3-d]pyrimidinyl)thio]ethanone IUPAC Name: 1-(azepan-1-yl)-2-(5,6-dimethyl-2-propylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanone Traditional Name: 1-(azepan-1-yl)-2-[(5,6-dimethyl-2-propyl-thieno[2,3-d]pyrimidin-4-yl)thio]ethanone Formula: C19H27N3OS2 MolecularWeight: 377.56718

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C(=C(S2)C)C)C(=N1)SCC(=O)N3CCCCCC3

Isomeric SMILES

CCCC1=NC2=C(C(=C(S2)C)C)C(=N1)SCC(=O)N3CCCCCC3

InChI

InChI=1S/C19H27N3OS2/c1-4-9-15-20-18(17-13(2)14(3)25-19(17)21-15)24-12-16(23)22-10-7-5-6-8-11-22/h4-12H2,1-3H3