2-(1,3-benzoxazol-2-ylsulfanyl)-N-[3-cyclohexyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]ethanamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-[3-cyclohexyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]ethanamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-cyclohexyl-2,6-dioxo-pyrimidin-4-yl)acetamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-(3-cyclohexyl-2,6-dioxo-4-pyrimidinyl)acetamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-cyclohexyl-2,6-dioxopyrimidin-4-yl)acetamide Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-N-(3-cyclohexyl-2,6-diketo-pyrimidin-4-yl)acetamide Formula: C19H20N4O4S MolecularWeight: 400.4515

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=CC(=O)NC2=O)NC(=O)CSC3=NC4=CC=CC=C4O3

Isomeric SMILES

C1CCC(CC1)N2C(=CC(=O)NC2=O)NC(=O)CSC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C19H20N4O4S/c24-16-10-15(23(18(26)22-16)12-6-2-1-3-7-12)21-17(25)11-28-19-20-13-8-4-5-9-14(13)27-19/h4-5,8-10,12H,1-3,6-7,11H2,(H,21,25)(H,22,24,26)