2-methyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-5-nitro-aniline

Systemtic Name: 2-methyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-5-nitro-aniline Openeye Name: 2-methyl-N-[1-(2-methylthiazol-4-yl)ethyl]-5-nitro-aniline CAS Name: 2-methyl-N-[1-(2-methyl-4-thiazolyl)ethyl]-5-nitroaniline IUPAC Name: 2-methyl-N-[1-(2-methyl-1,3-thiazol-4-yl)ethyl]-5-nitroaniline Traditional Name: (2-methyl-5-nitro-phenyl)-[1-(2-methylthiazol-4-yl)ethyl]amine Formula: C13H15N3O2S MolecularWeight: 277.3421

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(C)C2=CSC(=N2)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NC(C)C2=CSC(=N2)C

InChI

InChI=1S/C13H15N3O2S/c1-8-4-5-11(16(17)18)6-12(8)14-9(2)13-7-19-10(3)15-13/h4-7,9,14H,1-3H3