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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC4=CC=CC=C4C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC4=CC=CC=C4C=C3)[N+](=O)[O-]

InChI

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