4-methylsulfanyl-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]benzamide

Systemtic Name: 4-methylsulfanyl-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]benzamide Openeye Name: 4-methylsulfanyl-N-[5-(4-nitrophenyl)sulfonylthiazol-2-yl]benzamide CAS Name: 4-(methylthio)-N-[5-(4-nitrophenyl)sulfonyl-2-thiazolyl]benzamide IUPAC Name: 4-methylsulfanyl-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]benzamide Traditional Name: 4-(methylthio)-N-(5-nosylthiazol-2-yl)benzamide Formula: C17H13N3O5S3 MolecularWeight: 435.49722

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)NC2=NC=C(S2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)NC2=NC=C(S2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O5S3/c1-26-13-6-2-11(3-7-13)16(21)19-17-18-10-15(27-17)28(24,25)14-8-4-12(5-9-14)20(22)23/h2-10H,1H3,(H,18,19,21)