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

Systemtic Name: N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-2,4-dinitro-aniline Openeye Name: N-[2-(2-methylthiazol-4-yl)ethyl]-2,4-dinitro-aniline CAS Name: N-[2-(2-methyl-4-thiazolyl)ethyl]-2,4-dinitroaniline IUPAC Name: N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]-2,4-dinitroaniline Traditional Name: (2,4-dinitrophenyl)-[2-(2-methylthiazol-4-yl)ethyl]amine Formula: C12H12N4O4S MolecularWeight: 308.31308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)CCNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=CS1)CCNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H12N4O4S/c1-8-14-9(7-21-8)4-5-13-11-3-2-10(15(17)18)6-12(11)16(19)20/h2-3,6-7,13H,4-5H2,1H3