1-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-N-(2-oxidanylideneazepan-3-yl)-5-propyl-pyrazole-4-carboxamide

Systemtic Name: 1-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-N-(2-oxidanylideneazepan-3-yl)-5-propyl-pyrazole-4-carboxamide Openeye Name: 1-[4-(3-methoxyphenyl)thiazol-2-yl]-N-(2-oxoazepan-3-yl)-5-propyl-pyrazole-4-carboxamide CAS Name: 1-[4-(3-methoxyphenyl)-2-thiazolyl]-N-(2-oxo-3-azepanyl)-5-propyl-4-pyrazolecarboxamide IUPAC Name: 1-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]-N-(2-oxoazepan-3-yl)-5-propylpyrazole-4-carboxamide Traditional Name: N-(2-ketoazepan-3-yl)-1-[4-(3-methoxyphenyl)thiazol-2-yl]-5-propyl-pyrazole-4-carboxamide Formula: C23H27N5O3S MolecularWeight: 453.55718

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=NN1C2=NC(=CS2)C3=CC(=CC=C3)OC)C(=O)NC4CCCCNC4=O

Isomeric SMILES

CCCC1=C(C=NN1C2=NC(=CS2)C3=CC(=CC=C3)OC)C(=O)NC4CCCCNC4=O

InChI

InChI=1S/C23H27N5O3S/c1-3-7-20-17(21(29)26-18-10-4-5-11-24-22(18)30)13-25-28(20)23-27-19(14-32-23)15-8-6-9-16(12-15)31-2/h6,8-9,12-14,18H,3-5,7,10-11H2,1-2H3,(H,24,30)(H,26,29)