N-(1-adamantylmethyl)-2-phenyl-5-thiophen-2-yl-pyrazole-3-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-2-phenyl-5-thiophen-2-yl-pyrazole-3-carboxamide Openeye Name: N-(1-adamantylmethyl)-2-phenyl-5-(2-thienyl)pyrazole-3-carboxamide CAS Name: N-(1-adamantylmethyl)-2-phenyl-5-thiophen-2-yl-3-pyrazolecarboxamide IUPAC Name: N-(1-adamantylmethyl)-2-phenyl-5-thiophen-2-ylpyrazole-3-carboxamide Traditional Name: N-(1-adamantylmethyl)-2-phenyl-5-(2-thienyl)pyrazole-3-carboxamide Formula: C25H27N3OS MolecularWeight: 417.56638

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=CC(=NN4C5=CC=CC=C5)C6=CC=CS6

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=CC(=NN4C5=CC=CC=C5)C6=CC=CS6

InChI

InChI=1S/C25H27N3OS/c29-24(26-16-25-13-17-9-18(14-25)11-19(10-17)15-25)22-12-21(23-7-4-8-30-23)27-28(22)20-5-2-1-3-6-20/h1-8,12,17-19H,9-11,13-16H2,(H,26,29)