4-(2-bromanyl-6-methyl-phenyl)-N-(3-cyclopentylpropyl)-5-oxidanylidene-1,2,3,4-tetrazole-1-carboxamide

Systemtic Name: 4-(2-bromanyl-6-methyl-phenyl)-N-(3-cyclopentylpropyl)-5-oxidanylidene-1,2,3,4-tetrazole-1-carboxamide Openeye Name: 4-(2-bromo-6-methyl-phenyl)-N-(3-cyclopentylpropyl)-5-oxo-tetrazole-1-carboxamide CAS Name: 4-(2-bromo-6-methylphenyl)-N-(3-cyclopentylpropyl)-5-oxo-1-tetrazolecarboxamide IUPAC Name: 4-(2-bromo-6-methylphenyl)-N-(3-cyclopentylpropyl)-5-oxotetrazole-1-carboxamide Traditional Name: 4-(2-bromo-6-methyl-phenyl)-N-(3-cyclopentylpropyl)-5-keto-tetrazole-1-carboxamide Formula: C17H22BrN5O2 MolecularWeight: 408.29288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)Br)N2C(=O)N(N=N2)C(=O)NCCCC3CCCC3

Isomeric SMILES

CC1=C(C(=CC=C1)Br)N2C(=O)N(N=N2)C(=O)NCCCC3CCCC3

InChI

InChI=1S/C17H22BrN5O2/c1-12-6-4-10-14(18)15(12)22-17(25)23(21-20-22)16(24)19-11-5-9-13-7-2-3-8-13/h4,6,10,13H,2-3,5,7-9,11H2,1H3,(H,19,24)