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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)NCC2=CSC(=N2)C)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C=C(C=C1)NCC2=CSC(=N2)C)[N+](=O)[O-]

InChI

InChI=1S/C13H15N3O2S/c1-3-10-4-5-11(6-13(10)16(17)18)14-7-12-8-19-9(2)15-12/h4-6,8,14H,3,7H2,1-2H3