4-tert-butyl-N-[3-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propanoyl]benzamide

Systemtic Name: 4-tert-butyl-N-[3-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propanoyl]benzamide Openeye Name: 4-tert-butyl-N-[3-(1-cyclopentyltetrazol-5-yl)sulfanylpropanoyl]benzamide CAS Name: 4-tert-butyl-N-[3-[(1-cyclopentyl-5-tetrazolyl)thio]-1-oxopropyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-(1-cyclopentyltetrazol-5-yl)sulfanylpropanoyl]benzamide Traditional Name: 4-tert-butyl-N-[3-[(1-cyclopentyltetrazol-5-yl)thio]propanoyl]benzamide Formula: C20H27N5O2S MolecularWeight: 401.52568

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=O)CCSC2=NN=NN2C3CCCC3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=O)CCSC2=NN=NN2C3CCCC3

InChI

InChI=1S/C20H27N5O2S/c1-20(2,3)15-10-8-14(9-11-15)18(27)21-17(26)12-13-28-19-22-23-24-25(19)16-6-4-5-7-16/h8-11,16H,4-7,12-13H2,1-3H3,(H,21,26,27)