2-chloranyl-5-[4-(3-methoxy-2-oxidanyl-propyl)-3,5-bis(oxidanylidene)-1,2,4-triazin-2-yl]-N-[(1-oxidanylcyclohexyl)methyl]benzamide

Systemtic Name: 2-chloranyl-5-[4-(3-methoxy-2-oxidanyl-propyl)-3,5-bis(oxidanylidene)-1,2,4-triazin-2-yl]-N-[(1-oxidanylcyclohexyl)methyl]benzamide Openeye Name: 2-chloro-N-[(1-hydroxycyclohexyl)methyl]-5-[4-(2-hydroxy-3-methoxy-propyl)-3,5-dioxo-1,2,4-triazin-2-yl]benzamide CAS Name: 2-chloro-N-[(1-hydroxycyclohexyl)methyl]-5-[4-(2-hydroxy-3-methoxypropyl)-3,5-dioxo-1,2,4-triazin-2-yl]benzamide IUPAC Name: 2-chloro-N-[(1-hydroxycyclohexyl)methyl]-5-[4-(2-hydroxy-3-methoxypropyl)-3,5-dioxo-1,2,4-triazin-2-yl]benzamide Traditional Name: 2-chloro-N-[(1-hydroxycyclohexyl)methyl]-5-[4-(2-hydroxy-3-methoxy-propyl)-3,5-diketo-1,2,4-triazin-2-yl]benzamide Formula: C21H27ClN4O6 MolecularWeight: 466.91528

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Descriptors Computed from Structure

Canonical SMILES:

COCC(CN1C(=O)C=NN(C1=O)C2=CC(=C(C=C2)Cl)C(=O)NCC3(CCCCC3)O)O

Isomeric SMILES

COCC(CN1C(=O)C=NN(C1=O)C2=CC(=C(C=C2)Cl)C(=O)NCC3(CCCCC3)O)O

InChI

InChI=1S/C21H27ClN4O6/c1-32-12-15(27)11-25-18(28)10-24-26(20(25)30)14-5-6-17(22)16(9-14)19(29)23-13-21(31)7-3-2-4-8-21/h5-6,9-10,15,27,31H,2-4,7-8,11-13H2,1H3,(H,23,29)