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

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-3-(5-methyl-1,2,3,4-tetrazol-2-yl)adamantane-1-carboxamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-3-(5-methyltetrazol-2-yl)adamantane-1-carboxamide CAS Name: N-(3-chloro-4-methylphenyl)-3-(5-methyl-2-tetrazolyl)-1-adamantanecarboxamide IUPAC Name: N-(3-chloro-4-methylphenyl)-3-(5-methyltetrazol-2-yl)adamantane-1-carboxamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-3-(5-methyltetrazol-2-yl)adamantane-1-carboxamide Formula: C20H24ClN5O MolecularWeight: 385.89046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C23CC4CC(C2)CC(C4)(C3)N5N=C(N=N5)C)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C23CC4CC(C2)CC(C4)(C3)N5N=C(N=N5)C)Cl

InChI

InChI=1S/C20H24ClN5O/c1-12-3-4-16(6-17(12)21)22-18(27)19-7-14-5-15(8-19)10-20(9-14,11-19)26-24-13(2)23-25-26/h3-4,6,14-15H,5,7-11H2,1-2H3,(H,22,27)