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

Systemtic Name: N-[[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl]-3-nitro-aniline Openeye Name: N-[[2-(3,4-dimethoxyphenyl)thiazol-4-yl]methyl]-3-nitro-aniline CAS Name: N-[[2-(3,4-dimethoxyphenyl)-4-thiazolyl]methyl]-3-nitroaniline IUPAC Name: N-[[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl]-3-nitroaniline Traditional Name: [2-(3,4-dimethoxyphenyl)thiazol-4-yl]methyl-(3-nitrophenyl)amine Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CS2)CNC3=CC(=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=CS2)CNC3=CC(=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C18H17N3O4S/c1-24-16-7-6-12(8-17(16)25-2)18-20-14(11-26-18)10-19-13-4-3-5-15(9-13)21(22)23/h3-9,11,19H,10H2,1-2H3