3-(3-chloranyl-1,2,4-triazol-1-yl)-N-(2-methyl-4-oxidanyl-5-propan-2-yl-phenyl)adamantane-1-carboxamide

Systemtic Name: 3-(3-chloranyl-1,2,4-triazol-1-yl)-N-(2-methyl-4-oxidanyl-5-propan-2-yl-phenyl)adamantane-1-carboxamide Openeye Name: 3-(3-chloro-1,2,4-triazol-1-yl)-N-(4-hydroxy-5-isopropyl-2-methyl-phenyl)adamantane-1-carboxamide CAS Name: 3-(3-chloro-1,2,4-triazol-1-yl)-N-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-1-adamantanecarboxamide IUPAC Name: 3-(3-chloro-1,2,4-triazol-1-yl)-N-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)adamantane-1-carboxamide Traditional Name: 3-(3-chloro-1,2,4-triazol-1-yl)-N-(4-hydroxy-5-isopropyl-2-methyl-phenyl)adamantane-1-carboxamide Formula: C23H29ClN4O2 MolecularWeight: 428.95496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)O)C(C)C)NC(=O)C23CC4CC(C2)CC(C4)(C3)N5C=NC(=N5)Cl

Isomeric SMILES

CC1=C(C=C(C(=C1)O)C(C)C)NC(=O)C23CC4CC(C2)CC(C4)(C3)N5C=NC(=N5)Cl

InChI

InChI=1S/C23H29ClN4O2/c1-13(2)17-6-18(14(3)4-19(17)29)26-20(30)22-7-15-5-16(8-22)10-23(9-15,11-22)28-12-25-21(24)27-28/h4,6,12-13,15-16,29H,5,7-11H2,1-3H3,(H,26,30)