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

Systemtic Name: N-[(4-naphthalen-2-yl-1,3-thiazol-2-yl)carbamothioyl]-2-nitro-benzamide Openeye Name: N-[[4-(2-naphthyl)thiazol-2-yl]carbamothioyl]-2-nitro-benzamide CAS Name: N-[[[4-(2-naphthalenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]-2-nitrobenzamide IUPAC Name: N-[(4-naphthalen-2-yl-1,3-thiazol-2-yl)carbamothioyl]-2-nitrobenzamide Traditional Name: N-[[4-(2-naphthyl)thiazol-2-yl]thiocarbamoyl]-2-nitro-benzamide Formula: C21H14N4O3S2 MolecularWeight: 434.49086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C3=CSC(=N3)NC(=S)NC(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C3=CSC(=N3)NC(=S)NC(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H14N4O3S2/c26-19(16-7-3-4-8-18(16)25(27)28)23-20(29)24-21-22-17(12-30-21)15-10-9-13-5-1-2-6-14(13)11-15/h1-12H,(H2,22,23,24,26,29)