2-[[1-(4-butylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-prop-2-enyl-propanamide

Systemtic Name: 2-[[1-(4-butylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-prop-2-enyl-propanamide Openeye Name: N-allyl-2-[1-(4-butylphenyl)tetrazol-5-yl]sulfanyl-propanamide CAS Name: 2-[[1-(4-butylphenyl)-5-tetrazolyl]thio]-N-prop-2-enylpropanamide IUPAC Name: 2-[1-(4-butylphenyl)tetrazol-5-yl]sulfanyl-N-prop-2-enylpropanamide Traditional Name: N-allyl-2-[[1-(4-butylphenyl)tetrazol-5-yl]thio]propionamide Formula: C17H23N5OS MolecularWeight: 345.46242

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=NN=N2)SC(C)C(=O)NCC=C

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=NN=N2)SC(C)C(=O)NCC=C

InChI

InChI=1S/C17H23N5OS/c1-4-6-7-14-8-10-15(11-9-14)22-17(19-20-21-22)24-13(3)16(23)18-12-5-2/h5,8-11,13H,2,4,6-7,12H2,1,3H3,(H,18,23)