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

Systemtic Name: N-[[3-(tert-butylcarbamoyl)phenyl]carbamothioyl]-3-iodanyl-4-methyl-benzamide Openeye Name: N-[[3-(tert-butylcarbamoyl)phenyl]carbamothioyl]-3-iodo-4-methyl-benzamide CAS Name: N-[[3-[(tert-butylamino)-oxomethyl]anilino]-sulfanylidenemethyl]-3-iodo-4-methylbenzamide IUPAC Name: N-[[3-(tert-butylcarbamoyl)phenyl]carbamothioyl]-3-iodo-4-methylbenzamide Traditional Name: N-[[3-(tert-butylcarbamoyl)phenyl]thiocarbamoyl]-3-iodo-4-methyl-benzamide Formula: C20H22IN3O2S MolecularWeight: 495.37705

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)NC(C)(C)C)I

Isomeric SMILES

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

InChI

InChI=1S/C20H22IN3O2S/c1-12-8-9-14(11-16(12)21)17(25)23-19(27)22-15-7-5-6-13(10-15)18(26)24-20(2,3)4/h5-11H,1-4H3,(H,24,26)(H2,22,23,25,27)