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

Systemtic Name: 3-[4-(4-methyl-3-nitro-phenyl)-1,3-thiazol-2-yl]aniline Openeye Name: 3-[4-(4-methyl-3-nitro-phenyl)thiazol-2-yl]aniline CAS Name: 3-[4-(4-methyl-3-nitrophenyl)-2-thiazolyl]aniline IUPAC Name: 3-[4-(4-methyl-3-nitrophenyl)-1,3-thiazol-2-yl]aniline Traditional Name: [3-[4-(4-methyl-3-nitro-phenyl)thiazol-2-yl]phenyl]amine Formula: C16H13N3O2S MolecularWeight: 311.35832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC(=N2)C3=CC(=CC=C3)N)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC(=N2)C3=CC(=CC=C3)N)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O2S/c1-10-5-6-11(8-15(10)19(20)21)14-9-22-16(18-14)12-3-2-4-13(17)7-12/h2-9H,17H2,1H3