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

Systemtic Name: 3-chloranyl-N-[3-(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)phenyl]adamantane-1-carboxamide Openeye Name: 3-chloro-N-[3-(1-cyclopropyltetrazol-5-yl)phenyl]adamantane-1-carboxamide CAS Name: 3-chloro-N-[3-(1-cyclopropyl-5-tetrazolyl)phenyl]-1-adamantanecarboxamide IUPAC Name: 3-chloro-N-[3-(1-cyclopropyltetrazol-5-yl)phenyl]adamantane-1-carboxamide Traditional Name: 3-chloro-N-[3-(1-cyclopropyltetrazol-5-yl)phenyl]adamantane-1-carboxamide Formula: C21H24ClN5O MolecularWeight: 397.90116

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=N2)C3=CC(=CC=C3)NC(=O)C45CC6CC(C4)CC(C6)(C5)Cl

Isomeric SMILES

C1CC1N2C(=NN=N2)C3=CC(=CC=C3)NC(=O)C45CC6CC(C4)CC(C6)(C5)Cl

InChI

InChI=1S/C21H24ClN5O/c22-21-10-13-6-14(11-21)9-20(8-13,12-21)19(28)23-16-3-1-2-15(7-16)18-24-25-26-27(18)17-4-5-17/h1-3,7,13-14,17H,4-6,8-12H2,(H,23,28)