N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-thiophen-2-yl]-4-[bis(prop-2-enyl)sulfamoyl]benzamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-thiophen-2-yl]-4-[bis(prop-2-enyl)sulfamoyl]benzamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-2-thienyl]-4-(diallylsulfamoyl)benzamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-2-thiophenyl]-4-[bis(prop-2-enyl)sulfamoyl]benzamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methylthiophen-2-yl]-4-[bis(prop-2-enyl)sulfamoyl]benzamide Traditional Name: N-(3-cyano-4-methyl-5-piperonyl-2-thienyl)-4-(diallylsulfamoyl)benzamide Formula: C27H25N3O5S2 MolecularWeight: 535.6345

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N(CC=C)CC=C)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N(CC=C)CC=C)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C27H25N3O5S2/c1-4-12-30(13-5-2)37(32,33)21-9-7-20(8-10-21)26(31)29-27-22(16-28)18(3)25(36-27)15-19-6-11-23-24(14-19)35-17-34-23/h4-11,14H,1-2,12-13,15,17H2,3H3,(H,29,31)