2-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-cyclohexyl-6-methyl-6,7-dihydrothieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-cyclohexyl-6-methyl-6,7-dihydrothieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[2-(azepan-1-yl)-2-oxo-ethyl]sulfanyl-3-cyclohexyl-6-methyl-6,7-dihydrothieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[2-(1-azepanyl)-2-oxoethyl]thio]-3-cyclohexyl-6-methyl-6,7-dihydrothieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-[2-(azepan-1-yl)-2-oxoethyl]sulfanyl-3-cyclohexyl-6-methyl-6,7-dihydrothieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[[2-(azepan-1-yl)-2-keto-ethyl]thio]-3-cyclohexyl-6-methyl-6,7-dihydrothieno[3,2-d]pyrimidin-4-one Formula: C21H31N3O2S2 MolecularWeight: 421.61974

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(S1)C(=O)N(C(=N2)SCC(=O)N3CCCCCC3)C4CCCCC4

Isomeric SMILES

CC1CC2=C(S1)C(=O)N(C(=N2)SCC(=O)N3CCCCCC3)C4CCCCC4

InChI

InChI=1S/C21H31N3O2S2/c1-15-13-17-19(28-15)20(26)24(16-9-5-4-6-10-16)21(22-17)27-14-18(25)23-11-7-2-3-8-12-23/h15-16H,2-14H2,1H3