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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[[1-(2-methoxy-5-methyl-phenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[1-(2-methoxy-5-methyl-phenyl)tetrazol-5-yl]sulfanyl-propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[[1-(2-methoxy-5-methylphenyl)-5-tetrazolyl]thio]propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[1-(2-methoxy-5-methylphenyl)tetrazol-5-yl]sulfanylpropanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-[[1-(2-methoxy-5-methyl-phenyl)tetrazol-5-yl]thio]propionamide Formula: C19H19N5O4S MolecularWeight: 413.45026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)N2C(=NN=N2)SC(C)C(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=C(C=C1)OC)N2C(=NN=N2)SC(C)C(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H19N5O4S/c1-11-4-6-15(26-3)14(8-11)24-19(21-22-23-24)29-12(2)18(25)20-13-5-7-16-17(9-13)28-10-27-16/h4-9,12H,10H2,1-3H3,(H,20,25)