4-methoxy-N-[(4-naphthalen-1-yl-1,3-thiazol-2-yl)carbamothioyl]-3-nitro-benzamide

Systemtic Name: 4-methoxy-N-[(4-naphthalen-1-yl-1,3-thiazol-2-yl)carbamothioyl]-3-nitro-benzamide Openeye Name: 4-methoxy-N-[[4-(1-naphthyl)thiazol-2-yl]carbamothioyl]-3-nitro-benzamide CAS Name: 4-methoxy-N-[[[4-(1-naphthalenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: 4-methoxy-N-[(4-naphthalen-1-yl-1,3-thiazol-2-yl)carbamothioyl]-3-nitrobenzamide Traditional Name: 4-methoxy-N-[[4-(1-naphthyl)thiazol-2-yl]thiocarbamoyl]-3-nitro-benzamide Formula: C22H16N4O4S2 MolecularWeight: 464.51684

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC=CC4=CC=CC=C43)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC=CC4=CC=CC=C43)[N+](=O)[O-]

InChI

InChI=1S/C22H16N4O4S2/c1-30-19-10-9-14(11-18(19)26(28)29)20(27)24-21(31)25-22-23-17(12-32-22)16-8-4-6-13-5-2-3-7-15(13)16/h2-12H,1H3,(H2,23,24,25,27,31)