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

Systemtic Name: 2-butylsulfanyl-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]ethanamide Openeye Name: 2-butylsulfanyl-N-[5-(4-nitrophenyl)sulfonylthiazol-2-yl]acetamide CAS Name: 2-(butylthio)-N-[5-(4-nitrophenyl)sulfonyl-2-thiazolyl]acetamide IUPAC Name: 2-butylsulfanyl-N-[5-(4-nitrophenyl)sulfonyl-1,3-thiazol-2-yl]acetamide Traditional Name: 2-(butylthio)-N-(5-nosylthiazol-2-yl)acetamide Formula: C15H17N3O5S3 MolecularWeight: 415.50758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCC(=O)NC1=NC=C(S1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCSCC(=O)NC1=NC=C(S1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O5S3/c1-2-3-8-24-10-13(19)17-15-16-9-14(25-15)26(22,23)12-6-4-11(5-7-12)18(20)21/h4-7,9H,2-3,8,10H2,1H3,(H,16,17,19)