N-(1-adamantyl)-2-[(3-cyclopentyl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(1-adamantyl)-2-[(3-cyclopentyl-4-oxidanylidene-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]ethanamide Openeye Name: N-(1-adamantyl)-2-[(3-cyclopentyl-4-oxo-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide CAS Name: N-(1-adamantyl)-2-[(3-cyclopentyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)thio]acetamide IUPAC Name: N-(1-adamantyl)-2-[(3-cyclopentyl-4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)sulfanyl]acetamide Traditional Name: N-(1-adamantyl)-2-[(3-cyclopentyl-4-keto-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl)thio]acetamide Formula: C27H35N3O2S2 MolecularWeight: 497.7157

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=O)C3=C(N=C2SCC(=O)NC45CC6CC(C4)CC(C6)C5)SC7=C3CCCC7

Isomeric SMILES

C1CCC(C1)N2C(=O)C3=C(N=C2SCC(=O)NC45CC6CC(C4)CC(C6)C5)SC7=C3CCCC7

InChI

InChI=1S/C27H35N3O2S2/c31-22(29-27-12-16-9-17(13-27)11-18(10-16)14-27)15-33-26-28-24-23(20-7-3-4-8-21(20)34-24)25(32)30(26)19-5-1-2-6-19/h16-19H,1-15H2,(H,29,31)