4-(2-ethyl-5-methyl-pyrazol-3-yl)carbonyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one

Systemtic Name: 4-(2-ethyl-5-methyl-pyrazol-3-yl)carbonyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one Openeye Name: 4-(2-ethyl-5-methyl-pyrazole-3-carbonyl)-1-[(2-methylthiazol-4-yl)methyl]-6-(2-pyridylmethoxy)-1,4-diazepan-2-one CAS Name: 4-[(2-ethyl-5-methyl-3-pyrazolyl)-oxomethyl]-1-[(2-methyl-4-thiazolyl)methyl]-6-(2-pyridinylmethoxy)-1,4-diazepan-2-one IUPAC Name: 4-(2-ethyl-5-methylpyrazole-3-carbonyl)-1-[(2-methyl-1,3-thiazol-4-yl)methyl]-6-(pyridin-2-ylmethoxy)-1,4-diazepan-2-one Traditional Name: 4-(2-ethyl-5-methyl-pyrazole-3-carbonyl)-1-[(2-methylthiazol-4-yl)methyl]-6-(2-pyridylmethoxy)-1,4-diazepan-2-one Formula: C23H28N6O3S MolecularWeight: 468.57182

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC(=N1)C)C(=O)N2CC(CN(C(=O)C2)CC3=CSC(=N3)C)OCC4=CC=CC=N4

Isomeric SMILES

CCN1C(=CC(=N1)C)C(=O)N2CC(CN(C(=O)C2)CC3=CSC(=N3)C)OCC4=CC=CC=N4

InChI

InChI=1S/C23H28N6O3S/c1-4-29-21(9-16(2)26-29)23(31)28-12-20(32-14-18-7-5-6-8-24-18)11-27(22(30)13-28)10-19-15-33-17(3)25-19/h5-9,15,20H,4,10-14H2,1-3H3