N-(1-adamantylmethyl)-5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-5-chloranyl-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide Openeye Name: N-(1-adamantylmethyl)-5-chloro-3-methyl-1-(p-tolylmethyl)pyrazole-4-carboxamide CAS Name: N-(1-adamantylmethyl)-5-chloro-3-methyl-1-[(4-methylphenyl)methyl]-4-pyrazolecarboxamide IUPAC Name: N-(1-adamantylmethyl)-5-chloro-3-methyl-1-[(4-methylphenyl)methyl]pyrazole-4-carboxamide Traditional Name: N-(1-adamantylmethyl)-5-chloro-3-methyl-1-(4-methylbenzyl)pyrazole-4-carboxamide Formula: C24H30ClN3O MolecularWeight: 411.9675

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)NCC34CC5CC(C3)CC(C5)C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)C)C(=O)NCC34CC5CC(C3)CC(C5)C4)Cl

InChI

InChI=1S/C24H30ClN3O/c1-15-3-5-17(6-4-15)13-28-22(25)21(16(2)27-28)23(29)26-14-24-10-18-7-19(11-24)9-20(8-18)12-24/h3-6,18-20H,7-14H2,1-2H3,(H,26,29)