N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]ethanamide

Systemtic Name: N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]ethanamide Openeye Name: N-(4,5-dimethylthiazol-2-yl)-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]acetamide CAS Name: N-(4,5-dimethyl-2-thiazolyl)-2-[(4-methoxy-3-nitrophenyl)methylthio]acetamide IUPAC Name: N-(4,5-dimethyl-1,3-thiazol-2-yl)-2-[(4-methoxy-3-nitrophenyl)methylsulfanyl]acetamide Traditional Name: N-(4,5-dimethylthiazol-2-yl)-2-[(4-methoxy-3-nitro-benzyl)thio]acetamide Formula: C15H17N3O4S2 MolecularWeight: 367.44318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CSCC2=CC(=C(C=C2)OC)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CSCC2=CC(=C(C=C2)OC)[N+](=O)[O-])C

InChI

InChI=1S/C15H17N3O4S2/c1-9-10(2)24-15(16-9)17-14(19)8-23-7-11-4-5-13(22-3)12(6-11)18(20)21/h4-6H,7-8H2,1-3H3,(H,16,17,19)