cyclohexylmethyl 4-[2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoylamino]benzoate

Systemtic Name: cyclohexylmethyl 4-[2-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: cyclohexylmethyl 4-[[2-(1-methyltetrazol-5-yl)sulfanylacetyl]amino]benzoate CAS Name: 4-[[2-[(1-methyl-5-tetrazolyl)thio]-1-oxoethyl]amino]benzoic acid cyclohexylmethyl ester IUPAC Name: cyclohexylmethyl 4-[[2-(1-methyltetrazol-5-yl)sulfanylacetyl]amino]benzoate Traditional Name: 4-[[2-[(1-methyltetrazol-5-yl)thio]acetyl]amino]benzoic acid cyclohexylmethyl ester Formula: C18H23N5O3S MolecularWeight: 389.47192

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=N1)SCC(=O)NC2=CC=C(C=C2)C(=O)OCC3CCCCC3

Isomeric SMILES

CN1C(=NN=N1)SCC(=O)NC2=CC=C(C=C2)C(=O)OCC3CCCCC3

InChI

InChI=1S/C18H23N5O3S/c1-23-18(20-21-22-23)27-12-16(24)19-15-9-7-14(8-10-15)17(25)26-11-13-5-3-2-4-6-13/h7-10,13H,2-6,11-12H2,1H3,(H,19,24)