2-[(2R)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-5,6-dimethyl-3-propan-2-yl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(2R)-1-(azepan-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-5,6-dimethyl-3-propan-2-yl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(1R)-2-(azepan-1-yl)-1-methyl-2-oxo-ethyl]sulfanyl-3-isopropyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[(2R)-1-(1-azepanyl)-1-oxopropan-2-yl]thio]-5,6-dimethyl-3-propan-2-yl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(2R)-1-(azepan-1-yl)-1-oxopropan-2-yl]sulfanyl-5,6-dimethyl-3-propan-2-ylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[[(1R)-2-(azepan-1-yl)-2-keto-1-methyl-ethyl]thio]-3-isopropyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one Formula: C20H29N3O2S2 MolecularWeight: 407.59316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SC(C)C(=O)N3CCCCCC3)C(C)C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)S[C@H](C)C(=O)N3CCCCCC3)C(C)C)C

InChI

InChI=1S/C20H29N3O2S2/c1-12(2)23-19(25)16-13(3)14(4)26-17(16)21-20(23)27-15(5)18(24)22-10-8-6-7-9-11-22/h12,15H,6-11H2,1-5H3/t15-/m1/s1