1-[4-[2-(2-methyl-1,3-thiazol-4-yl)ethylamino]-3-nitro-phenyl]ethanone

Systemtic Name: 1-[4-[2-(2-methyl-1,3-thiazol-4-yl)ethylamino]-3-nitro-phenyl]ethanone Openeye Name: 1-[4-[2-(2-methylthiazol-4-yl)ethylamino]-3-nitro-phenyl]ethanone CAS Name: 1-[4-[2-(2-methyl-4-thiazolyl)ethylamino]-3-nitrophenyl]ethanone IUPAC Name: 1-[4-[2-(2-methyl-1,3-thiazol-4-yl)ethylamino]-3-nitrophenyl]ethanone Traditional Name: 1-[4-[2-(2-methylthiazol-4-yl)ethylamino]-3-nitro-phenyl]ethanone Formula: C14H15N3O3S MolecularWeight: 305.3522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N3O3S/c1-9(18)11-3-4-13(14(7-11)17(19)20)15-6-5-12-8-21-10(2)16-12/h3-4,7-8,15H,5-6H2,1-2H3