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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)C)I

Isomeric SMILES

CCCCNC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)C)I

InChI

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