N-[[2-[(3,4-dimethylphenyl)carbamoyl]phenyl]carbamothioyl]-3-iodanyl-4-methoxy-benzamide

Systemtic Name: N-[[2-[(3,4-dimethylphenyl)carbamoyl]phenyl]carbamothioyl]-3-iodanyl-4-methoxy-benzamide Openeye Name: N-[[2-[(3,4-dimethylphenyl)carbamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxy-benzamide CAS Name: N-[[2-[(3,4-dimethylanilino)-oxomethyl]anilino]-sulfanylidenemethyl]-3-iodo-4-methoxybenzamide IUPAC Name: N-[[2-[(3,4-dimethylphenyl)carbamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxybenzamide Traditional Name: N-[[2-[(3,4-dimethylphenyl)carbamoyl]phenyl]thiocarbamoyl]-3-iodo-4-methoxy-benzamide Formula: C24H22IN3O3S MolecularWeight: 559.41925

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC(=C(C=C3)OC)I)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2NC(=S)NC(=O)C3=CC(=C(C=C3)OC)I)C

InChI

InChI=1S/C24H22IN3O3S/c1-14-8-10-17(12-15(14)2)26-23(30)18-6-4-5-7-20(18)27-24(32)28-22(29)16-9-11-21(31-3)19(25)13-16/h4-13H,1-3H3,(H,26,30)(H2,27,28,29,32)