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

Systemtic Name: 3-iodanyl-4-methoxy-N-[[2-[(4-phenylazanylphenyl)carbamoyl]phenyl]carbamothioyl]benzamide Openeye Name: N-[[2-[(4-anilinophenyl)carbamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxy-benzamide CAS Name: N-[[2-[(4-anilinoanilino)-oxomethyl]anilino]-sulfanylidenemethyl]-3-iodo-4-methoxybenzamide IUPAC Name: N-[[2-[(4-anilinophenyl)carbamoyl]phenyl]carbamothioyl]-3-iodo-4-methoxybenzamide Traditional Name: N-[[2-[(4-anilinophenyl)carbamoyl]phenyl]thiocarbamoyl]-3-iodo-4-methoxy-benzamide Formula: C28H23IN4O3S MolecularWeight: 622.47669

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)NC4=CC=CC=C4)I

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)NC4=CC=CC=C4)I

InChI

InChI=1S/C28H23IN4O3S/c1-36-25-16-11-18(17-23(25)29)26(34)33-28(37)32-24-10-6-5-9-22(24)27(35)31-21-14-12-20(13-15-21)30-19-7-3-2-4-8-19/h2-17,30H,1H3,(H,31,35)(H2,32,33,34,37)