N-[[4-[bis(prop-2-enyl)sulfamoyl]phenyl]carbamothioyl]-3-cyclohexyl-propanamide

Systemtic Name: N-[[4-[bis(prop-2-enyl)sulfamoyl]phenyl]carbamothioyl]-3-cyclohexyl-propanamide Openeye Name: 3-cyclohexyl-N-[[4-(diallylsulfamoyl)phenyl]carbamothioyl]propanamide CAS Name: N-[[4-[bis(prop-2-enyl)sulfamoyl]anilino]-sulfanylidenemethyl]-3-cyclohexylpropanamide IUPAC Name: N-[[4-[bis(prop-2-enyl)sulfamoyl]phenyl]carbamothioyl]-3-cyclohexylpropanamide Traditional Name: 3-cyclohexyl-N-[[4-(diallylsulfamoyl)phenyl]thiocarbamoyl]propionamide Formula: C22H31N3O3S2 MolecularWeight: 449.62984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC=C)S(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CCC2CCCCC2

Isomeric SMILES

C=CCN(CC=C)S(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CCC2CCCCC2

InChI

InChI=1S/C22H31N3O3S2/c1-3-16-25(17-4-2)30(27,28)20-13-11-19(12-14-20)23-22(29)24-21(26)15-10-18-8-6-5-7-9-18/h3-4,11-14,18H,1-2,5-10,15-17H2,(H2,23,24,26,29)