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

Systemtic Name: 4-ethylsulfanyl-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]benzamide Openeye Name: 4-ethylsulfanyl-N-[5-(4-nitrophenyl)sulfonylthiazol-2-yl]benzamide CAS Name: 4-(ethylthio)-N-[5-(4-nitrophenyl)sulfonyl-2-thiazolyl]benzamide IUPAC Name: 4-ethylsulfanyl-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]benzamide Traditional Name: 4-(ethylthio)-N-(5-nosylthiazol-2-yl)benzamide Formula: C18H15N3O5S3 MolecularWeight: 449.5238

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)C(=O)NC2=NC=C(S2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCSC1=CC=C(C=C1)C(=O)NC2=NC=C(S2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O5S3/c1-2-27-14-7-3-12(4-8-14)17(22)20-18-19-11-16(28-18)29(25,26)15-9-5-13(6-10-15)21(23)24/h3-11H,2H2,1H3,(H,19,20,22)