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

Systemtic Name: N-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl]-3-nitro-aniline Openeye Name: 3-nitro-N-[[2-(p-tolyl)thiazol-4-yl]methyl]aniline CAS Name: N-[[2-(4-methylphenyl)-4-thiazolyl]methyl]-3-nitroaniline IUPAC Name: N-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl]-3-nitroaniline Traditional Name: (3-nitrophenyl)-[[2-(p-tolyl)thiazol-4-yl]methyl]amine Formula: C17H15N3O2S MolecularWeight: 325.3849

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)CNC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)CNC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H15N3O2S/c1-12-5-7-13(8-6-12)17-19-15(11-23-17)10-18-14-3-2-4-16(9-14)20(21)22/h2-9,11,18H,10H2,1H3