N-[2-(4-ethylsulfanyl-6-nitro-1,2,3,4-tetrahydroquinolin-2-yl)-2-methyl-propyl]ethanamide

Systemtic Name: N-[2-(4-ethylsulfanyl-6-nitro-1,2,3,4-tetrahydroquinolin-2-yl)-2-methyl-propyl]ethanamide Openeye Name: N-[2-(4-ethylsulfanyl-6-nitro-1,2,3,4-tetrahydroquinolin-2-yl)-2-methyl-propyl]acetamide CAS Name: N-[2-[4-(ethylthio)-6-nitro-1,2,3,4-tetrahydroquinolin-2-yl]-2-methylpropyl]acetamide IUPAC Name: N-[2-(4-ethylsulfanyl-6-nitro-1,2,3,4-tetrahydroquinolin-2-yl)-2-methylpropyl]acetamide Traditional Name: N-[2-[4-(ethylthio)-6-nitro-1,2,3,4-tetrahydroquinolin-2-yl]-2-methyl-propyl]acetamide Formula: C17H25N3O3S MolecularWeight: 351.4637

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1CC(NC2=C1C=C(C=C2)[N+](=O)[O-])C(C)(C)CNC(=O)C

Isomeric SMILES

CCSC1CC(NC2=C1C=C(C=C2)[N+](=O)[O-])C(C)(C)CNC(=O)C

InChI

InChI=1S/C17H25N3O3S/c1-5-24-15-9-16(17(3,4)10-18-11(2)21)19-14-7-6-12(20(22)23)8-13(14)15/h6-8,15-16,19H,5,9-10H2,1-4H3,(H,18,21)