N-(1,3-benzodioxol-5-yl)-2-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[(1-cyclohexyl-1,2,3,4-tetrazol-5-yl)sulfanyl]propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-(1-cyclohexyltetrazol-5-yl)sulfanyl-propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[(1-cyclohexyl-5-tetrazolyl)thio]propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-(1-cyclohexyltetrazol-5-yl)sulfanylpropanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[(1-cyclohexyltetrazol-5-yl)thio]propionamide Formula: C17H21N5O3S MolecularWeight: 375.44534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)OCO2)SC3=NN=NN3C4CCCCC4

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)OCO2)SC3=NN=NN3C4CCCCC4

InChI

InChI=1S/C17H21N5O3S/c1-11(16(23)18-12-7-8-14-15(9-12)25-10-24-14)26-17-19-20-21-22(17)13-5-3-2-4-6-13/h7-9,11,13H,2-6,10H2,1H3,(H,18,23)