ethane; N-methyl-4-nitro-N-[3-[(5-phenyl-1,2,4-thiadiazol-3-yl)oxy]propyl]aniline

Systemtic Name: ethane; N-methyl-4-nitro-N-[3-[(5-phenyl-1,2,4-thiadiazol-3-yl)oxy]propyl]aniline Openeye Name: ethane; N-methyl-4-nitro-N-[3-[(5-phenyl-1,2,4-thiadiazol-3-yl)oxy]propyl]aniline CAS Name: ethane; N-methyl-4-nitro-N-[3-[(5-phenyl-1,2,4-thiadiazol-3-yl)oxy]propyl]aniline IUPAC Name: ethane; N-methyl-4-nitro-N-[3-[(5-phenyl-1,2,4-thiadiazol-3-yl)oxy]propyl]aniline Traditional Name: ethane; methyl-(4-nitrophenyl)-[3-[(5-phenyl-1,2,4-thiadiazol-3-yl)oxy]propyl]amine Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

CC.CN(CCCOC1=NSC(=N1)C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC.CN(CCCOC1=NSC(=N1)C2=CC=CC=C2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O3S.C2H6/c1-21(15-8-10-16(11-9-15)22(23)24)12-5-13-25-18-19-17(26-20-18)14-6-3-2-4-7-14;1-2/h2-4,6-11H,5,12-13H2,1H3;1-2H3