(E)-N-[[(2,4-dichlorophenyl)carbonylamino]carbamothioyl]-3-naphthalen-1-yl-prop-2-enamide

Systemtic Name: (E)-N-[[(2,4-dichlorophenyl)carbonylamino]carbamothioyl]-3-naphthalen-1-yl-prop-2-enamide Openeye Name: (E)-N-[[(2,4-dichlorobenzoyl)amino]carbamothioyl]-3-(1-naphthyl)prop-2-enamide CAS Name: (E)-N-[[[(2,4-dichlorophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-(1-naphthalenyl)-2-propenamide IUPAC Name: (E)-N-[[(2,4-dichlorobenzoyl)amino]carbamothioyl]-3-naphthalen-1-ylprop-2-enamide Traditional Name: (E)-N-[[(2,4-dichlorobenzoyl)amino]thiocarbamoyl]-3-(1-naphthyl)acrylamide Formula: C21H15Cl2N3O2S MolecularWeight: 444.3337

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2/C=C/C(=O)NC(=S)NNC(=O)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H15Cl2N3O2S/c22-15-9-10-17(18(23)12-15)20(28)25-26-21(29)24-19(27)11-8-14-6-3-5-13-4-1-2-7-16(13)14/h1-12H,(H,25,28)(H2,24,26,27,29)/b11-8+