N-[[3-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-3-iodanyl-4-methyl-benzamide

Systemtic Name: N-[[3-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-3-iodanyl-4-methyl-benzamide Openeye Name: N-[[3-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-3-iodo-4-methyl-benzamide CAS Name: N-[[3-[(cyclohexylamino)-oxomethyl]anilino]-sulfanylidenemethyl]-3-iodo-4-methylbenzamide IUPAC Name: N-[[3-(cyclohexylcarbamoyl)phenyl]carbamothioyl]-3-iodo-4-methylbenzamide Traditional Name: N-[[3-(cyclohexylcarbamoyl)phenyl]thiocarbamoyl]-3-iodo-4-methyl-benzamide Formula: C22H24IN3O2S MolecularWeight: 521.41433

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3CCCCC3)I

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3CCCCC3)I

InChI

InChI=1S/C22H24IN3O2S/c1-14-10-11-16(13-19(14)23)21(28)26-22(29)25-18-9-5-6-15(12-18)20(27)24-17-7-3-2-4-8-17/h5-6,9-13,17H,2-4,7-8H2,1H3,(H,24,27)(H2,25,26,28,29)