1-cyclohexyl-4-(2-methylsulfanylpyridin-3-yl)carbonyl-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 1-cyclohexyl-4-(2-methylsulfanylpyridin-3-yl)carbonyl-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 1-cyclohexyl-4-(2-methylsulfanylpyridine-3-carbonyl)-6-(4-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 1-cyclohexyl-4-[[2-(methylthio)-3-pyridinyl]-oxomethyl]-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one IUPAC Name: 1-cyclohexyl-4-(2-methylsulfanylpyridine-3-carbonyl)-6-(pyridin-4-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 1-cyclohexyl-4-[2-(methylthio)nicotinoyl]-6-(4-pyridylmethoxy)-1,4-diazepan-2-one Formula: C24H30N4O3S MolecularWeight: 454.585

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)N2CC(CN(C(=O)C2)C3CCCCC3)OCC4=CC=NC=C4

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)N2CC(CN(C(=O)C2)C3CCCCC3)OCC4=CC=NC=C4

InChI

InChI=1S/C24H30N4O3S/c1-32-23-21(8-5-11-26-23)24(30)27-14-20(31-17-18-9-12-25-13-10-18)15-28(22(29)16-27)19-6-3-2-4-7-19/h5,8-13,19-20H,2-4,6-7,14-17H2,1H3