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

Systemtic Name: N-[[4-(butanoylamino)phenyl]carbamothioyl]-3-iodanyl-4-methyl-benzamide Openeye Name: N-[[4-(butanoylamino)phenyl]carbamothioyl]-3-iodo-4-methyl-benzamide CAS Name: 3-iodo-4-methyl-N-[[4-(1-oxobutylamino)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[4-(butanoylamino)phenyl]carbamothioyl]-3-iodo-4-methylbenzamide Traditional Name: N-[(4-butyramidophenyl)thiocarbamoyl]-3-iodo-4-methyl-benzamide Formula: C19H20IN3O2S MolecularWeight: 481.35047

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)C)I

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)C)I

InChI

InChI=1S/C19H20IN3O2S/c1-3-4-17(24)21-14-7-9-15(10-8-14)22-19(26)23-18(25)13-6-5-12(2)16(20)11-13/h5-11H,3-4H2,1-2H3,(H,21,24)(H2,22,23,25,26)