4-[4-(3-cyclohexylpropyl)-5-oxidanylidene-1,2,3,4-tetrazol-1-yl]benzenesulfonyl chloride

Systemtic Name: 4-[4-(3-cyclohexylpropyl)-5-oxidanylidene-1,2,3,4-tetrazol-1-yl]benzenesulfonyl chloride Openeye Name: 4-[4-(3-cyclohexylpropyl)-5-oxo-tetrazol-1-yl]benzenesulfonyl chloride CAS Name: 4-[4-(3-cyclohexylpropyl)-5-oxo-1-tetrazolyl]benzenesulfonyl chloride IUPAC Name: 4-[4-(3-cyclohexylpropyl)-5-oxotetrazol-1-yl]benzenesulfonyl chloride Traditional Name: 4-[4-(3-cyclohexylpropyl)-5-keto-tetrazol-1-yl]benzenesulfonyl chloride Formula: C16H21ClN4O3S MolecularWeight: 384.88094

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCCN2C(=O)N(N=N2)C3=CC=C(C=C3)S(=O)(=O)Cl

Isomeric SMILES

C1CCC(CC1)CCCN2C(=O)N(N=N2)C3=CC=C(C=C3)S(=O)(=O)Cl

InChI

InChI=1S/C16H21ClN4O3S/c17-25(23,24)15-10-8-14(9-11-15)21-16(22)20(18-19-21)12-4-7-13-5-2-1-3-6-13/h8-11,13H,1-7,12H2