N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]-2-thiophen-2-ylcarbonyl-cyclohexane-1-carboxamide

Systemtic Name: N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]-2-thiophen-2-ylcarbonyl-cyclohexane-1-carboxamide Openeye Name: N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]-2-(thiophene-2-carbonyl)cyclohexanecarboxamide CAS Name: N-[1-(3-methoxy-3-methylbutyl)-4-pyrazolyl]-2-[oxo(thiophen-2-yl)methyl]-1-cyclohexanecarboxamide IUPAC Name: N-[1-(3-methoxy-3-methylbutyl)pyrazol-4-yl]-2-(thiophene-2-carbonyl)cyclohexane-1-carboxamide Traditional Name: N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]-2-(2-thenoyl)cyclohexanecarboxamide Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCN1C=C(C=N1)NC(=O)C2CCCCC2C(=O)C3=CC=CS3)OC

Isomeric SMILES

CC(C)(CCN1C=C(C=N1)NC(=O)C2CCCCC2C(=O)C3=CC=CS3)OC

InChI

InChI=1S/C21H29N3O3S/c1-21(2,27-3)10-11-24-14-15(13-22-24)23-20(26)17-8-5-4-7-16(17)19(25)18-9-6-12-28-18/h6,9,12-14,16-17H,4-5,7-8,10-11H2,1-3H3,(H,23,26)