4-methylsulfanyl-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-3-nitro-benzamide

Systemtic Name: 4-methylsulfanyl-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-3-nitro-benzamide Openeye Name: 4-methylsulfanyl-N-[4-(2-naphthyl)thiazol-2-yl]-3-nitro-benzamide CAS Name: 4-(methylthio)-N-[4-(2-naphthalenyl)-2-thiazolyl]-3-nitrobenzamide IUPAC Name: 4-methylsulfanyl-N-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-3-nitrobenzamide Traditional Name: 4-(methylthio)-N-[4-(2-naphthyl)thiazol-2-yl]-3-nitro-benzamide Formula: C21H15N3O3S2 MolecularWeight: 421.4921

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(=O)NC2=NC(=CS2)C3=CC4=CC=CC=C4C=C3)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)C(=O)NC2=NC(=CS2)C3=CC4=CC=CC=C4C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H15N3O3S2/c1-28-19-9-8-16(11-18(19)24(26)27)20(25)23-21-22-17(12-29-21)15-7-6-13-4-2-3-5-14(13)10-15/h2-12H,1H3,(H,22,23,25)