N-[[(2-iodanylphenyl)carbonylamino]carbamothioyl]-3-naphthalen-1-yl-prop-2-enamide

Systemtic Name: N-[[(2-iodanylphenyl)carbonylamino]carbamothioyl]-3-naphthalen-1-yl-prop-2-enamide Openeye Name: N-[[(2-iodobenzoyl)amino]carbamothioyl]-3-(1-naphthyl)prop-2-enamide CAS Name: N-[[[(2-iodophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-(1-naphthalenyl)-2-propenamide IUPAC Name: N-[[(2-iodobenzoyl)amino]carbamothioyl]-3-naphthalen-1-ylprop-2-enamide Traditional Name: N-[[(2-iodobenzoyl)amino]thiocarbamoyl]-3-(1-naphthyl)acrylamide Formula: C21H16IN3O2S MolecularWeight: 501.34011

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C=CC(=O)NC(=S)NNC(=O)C3=CC=CC=C3I

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C=CC(=O)NC(=S)NNC(=O)C3=CC=CC=C3I

InChI

InChI=1S/C21H16IN3O2S/c22-18-11-4-3-10-17(18)20(27)24-25-21(28)23-19(26)13-12-15-8-5-7-14-6-1-2-9-16(14)15/h1-13H,(H,24,27)(H2,23,25,26,28)