N-[[2-[ethyl(phenyl)carbamoyl]phenyl]carbamothioyl]-3-iodanyl-4-methyl-benzamide

Systemtic Name: N-[[2-[ethyl(phenyl)carbamoyl]phenyl]carbamothioyl]-3-iodanyl-4-methyl-benzamide Openeye Name: N-[[2-[ethyl(phenyl)carbamoyl]phenyl]carbamothioyl]-3-iodo-4-methyl-benzamide CAS Name: N-[[2-[(N-ethylanilino)-oxomethyl]anilino]-sulfanylidenemethyl]-3-iodo-4-methylbenzamide IUPAC Name: N-[[2-[ethyl(phenyl)carbamoyl]phenyl]carbamothioyl]-3-iodo-4-methylbenzamide Traditional Name: N-[[2-[ethyl(phenyl)carbamoyl]phenyl]thiocarbamoyl]-3-iodo-4-methyl-benzamide Formula: C24H22IN3O2S MolecularWeight: 543.41985

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H22IN3O2S/c1-3-28(18-9-5-4-6-10-18)23(30)19-11-7-8-12-21(19)26-24(31)27-22(29)17-14-13-16(2)20(25)15-17/h4-15H,3H2,1-2H3,(H2,26,27,29,31)