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

Systemtic Name: N-[[2-[(4-fluoranylphenoxy)methyl]-1,3-thiazol-4-yl]methyl]-3-nitro-aniline Openeye Name: N-[[2-[(4-fluorophenoxy)methyl]thiazol-4-yl]methyl]-3-nitro-aniline CAS Name: N-[[2-[(4-fluorophenoxy)methyl]-4-thiazolyl]methyl]-3-nitroaniline IUPAC Name: N-[[2-[(4-fluorophenoxy)methyl]-1,3-thiazol-4-yl]methyl]-3-nitroaniline Traditional Name: [2-[(4-fluorophenoxy)methyl]thiazol-4-yl]methyl-(3-nitrophenyl)amine Formula: C17H14FN3O3S MolecularWeight: 359.374763

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NCC2=CSC(=N2)COC3=CC=C(C=C3)F

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NCC2=CSC(=N2)COC3=CC=C(C=C3)F

InChI

InChI=1S/C17H14FN3O3S/c18-12-4-6-16(7-5-12)24-10-17-20-14(11-25-17)9-19-13-2-1-3-15(8-13)21(22)23/h1-8,11,19H,9-10H2