N-cyclohexyl-2-[7-cyclopentyl-1,3-dimethyl-2,4-bis(oxidanylidene)pyrimido[4,5-d]pyrimidin-5-yl]sulfanyl-ethanamide

Systemtic Name: N-cyclohexyl-2-[7-cyclopentyl-1,3-dimethyl-2,4-bis(oxidanylidene)pyrimido[4,5-d]pyrimidin-5-yl]sulfanyl-ethanamide Openeye Name: N-cyclohexyl-2-(7-cyclopentyl-1,3-dimethyl-2,4-dioxo-pyrimido[4,5-d]pyrimidin-5-yl)sulfanyl-acetamide CAS Name: N-cyclohexyl-2-[(7-cyclopentyl-1,3-dimethyl-2,4-dioxo-5-pyrimido[4,5-d]pyrimidinyl)thio]acetamide IUPAC Name: N-cyclohexyl-2-(7-cyclopentyl-1,3-dimethyl-2,4-dioxopyrimido[4,5-d]pyrimidin-5-yl)sulfanylacetamide Traditional Name: N-cyclohexyl-2-[(7-cyclopentyl-2,4-diketo-1,3-dimethyl-pyrimido[4,5-d]pyrimidin-5-yl)thio]acetamide Formula: C21H29N5O3S MolecularWeight: 431.55166

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=NC(=N2)C3CCCC3)SCC(=O)NC4CCCCC4)C(=O)N(C1=O)C

Isomeric SMILES

CN1C2=C(C(=NC(=N2)C3CCCC3)SCC(=O)NC4CCCCC4)C(=O)N(C1=O)C

InChI

InChI=1S/C21H29N5O3S/c1-25-18-16(20(28)26(2)21(25)29)19(24-17(23-18)13-8-6-7-9-13)30-12-15(27)22-14-10-4-3-5-11-14/h13-14H,3-12H2,1-2H3,(H,22,27)