N-[4-(4-nitrothiophen-2-yl)-1,3-thiazol-2-yl]-2-(phenylmethyl)sulfonyl-ethanamide

Systemtic Name: N-[4-(4-nitrothiophen-2-yl)-1,3-thiazol-2-yl]-2-(phenylmethyl)sulfonyl-ethanamide Openeye Name: 2-benzylsulfonyl-N-[4-(4-nitro-2-thienyl)thiazol-2-yl]acetamide CAS Name: N-[4-(4-nitro-2-thiophenyl)-2-thiazolyl]-2-(phenylmethyl)sulfonylacetamide IUPAC Name: 2-benzylsulfonyl-N-[4-(4-nitrothiophen-2-yl)-1,3-thiazol-2-yl]acetamide Traditional Name: 2-benzylsulfonyl-N-[4-(4-nitro-2-thienyl)thiazol-2-yl]acetamide Formula: C16H13N3O5S3 MolecularWeight: 423.48652

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)CC(=O)NC2=NC(=CS2)C3=CC(=CS3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)CC(=O)NC2=NC(=CS2)C3=CC(=CS3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O5S3/c20-15(10-27(23,24)9-11-4-2-1-3-5-11)18-16-17-13(8-26-16)14-6-12(7-25-14)19(21)22/h1-8H,9-10H2,(H,17,18,20)