N-(3-chloranyl-4-methoxy-phenyl)-2-(1-cyclopentyl-6-oxidanyl-4-oxidanylidene-pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-2-(1-cyclopentyl-6-oxidanyl-4-oxidanylidene-pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-2-(1-cyclopentyl-6-hydroxy-4-oxo-pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(3-chloro-4-methoxyphenyl)-2-[(1-cyclopentyl-6-hydroxy-4-oxo-2-pyrimidinyl)thio]acetamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-2-(1-cyclopentyl-6-hydroxy-4-oxopyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-2-[(1-cyclopentyl-6-hydroxy-4-keto-pyrimidin-2-yl)thio]acetamide Formula: C18H20ClN3O4S MolecularWeight: 409.8871

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CSC2=NC(=O)C=C(N2C3CCCC3)O)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CSC2=NC(=O)C=C(N2C3CCCC3)O)Cl

InChI

InChI=1S/C18H20ClN3O4S/c1-26-14-7-6-11(8-13(14)19)20-16(24)10-27-18-21-15(23)9-17(25)22(18)12-4-2-3-5-12/h6-9,12,25H,2-5,10H2,1H3,(H,20,24)