N-[2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-5-methyl-pyrazol-3-yl]adamantane-1-carboxamide

Systemtic Name: N-[2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-5-methyl-pyrazol-3-yl]adamantane-1-carboxamide Openeye Name: N-[2-[4-(4-ethoxyphenyl)thiazol-2-yl]-5-methyl-pyrazol-3-yl]adamantane-1-carboxamide CAS Name: N-[2-[4-(4-ethoxyphenyl)-2-thiazolyl]-5-methyl-3-pyrazolyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-yl]adamantane-1-carboxamide Traditional Name: N-[5-methyl-2-(4-p-phenetylthiazol-2-yl)pyrazol-3-yl]adamantane-1-carboxamide Formula: C26H30N4O2S MolecularWeight: 462.607

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC(=N2)N3C(=CC(=N3)C)NC(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC(=N2)N3C(=CC(=N3)C)NC(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C26H30N4O2S/c1-3-32-21-6-4-20(5-7-21)22-15-33-25(27-22)30-23(8-16(2)29-30)28-24(31)26-12-17-9-18(13-26)11-19(10-17)14-26/h4-8,15,17-19H,3,9-14H2,1-2H3,(H,28,31)