N-[[4-(ethanoylcarbamothioylamino)phenyl]carbamothioyl]naphthalene-2-carboxamide

Systemtic Name: N-[[4-(ethanoylcarbamothioylamino)phenyl]carbamothioyl]naphthalene-2-carboxamide Openeye Name: N-[[4-(acetylcarbamothioylamino)phenyl]carbamothioyl]naphthalene-2-carboxamide CAS Name: N-[[4-[[acetamido(sulfanylidene)methyl]amino]anilino]-sulfanylidenemethyl]-2-naphthalenecarboxamide IUPAC Name: N-[[4-(acetylcarbamothioylamino)phenyl]carbamothioyl]naphthalene-2-carboxamide Traditional Name: N-[[4-(acetylthiocarbamoylamino)phenyl]thiocarbamoyl]-2-naphthamide Formula: C21H18N4O2S2 MolecularWeight: 422.52322

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(=S)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC(=O)NC(=S)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H18N4O2S2/c1-13(26)22-20(28)23-17-8-10-18(11-9-17)24-21(29)25-19(27)16-7-6-14-4-2-3-5-15(14)12-16/h2-12H,1H3,(H2,22,23,26,28)(H2,24,25,27,29)