N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]ethanamide

Systemtic Name: N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]ethanamide Openeye Name: N-(4-cyclopropylthiazol-2-yl)-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]acetamide CAS Name: N-(4-cyclopropyl-2-thiazolyl)-2-[(4-methoxy-3-nitrophenyl)methylthio]acetamide IUPAC Name: N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-[(4-methoxy-3-nitrophenyl)methylsulfanyl]acetamide Traditional Name: N-(4-cyclopropylthiazol-2-yl)-2-[(4-methoxy-3-nitro-benzyl)thio]acetamide Formula: C16H17N3O4S2 MolecularWeight: 379.45388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CSCC(=O)NC2=NC(=CS2)C3CC3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)CSCC(=O)NC2=NC(=CS2)C3CC3)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O4S2/c1-23-14-5-2-10(6-13(14)19(21)22)7-24-9-15(20)18-16-17-12(8-25-16)11-3-4-11/h2,5-6,8,11H,3-4,7,9H2,1H3,(H,17,18,20)