N-[3-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-2-methyl-imidazol-4-yl]-2-nitro-benzamide

Systemtic Name: N-[3-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-2-methyl-imidazol-4-yl]-2-nitro-benzamide Openeye Name: N-[3-[4-(4-ethoxyphenyl)thiazol-2-yl]-2-methyl-imidazol-4-yl]-2-nitro-benzamide CAS Name: N-[3-[4-(4-ethoxyphenyl)-2-thiazolyl]-2-methyl-4-imidazolyl]-2-nitrobenzamide IUPAC Name: N-[3-[4-(4-ethoxyphenyl)-1,3-thiazol-2-yl]-2-methylimidazol-4-yl]-2-nitrobenzamide Traditional Name: N-[2-methyl-3-(4-p-phenetylthiazol-2-yl)imidazol-4-yl]-2-nitro-benzamide Formula: C22H19N5O4S MolecularWeight: 449.48236

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC(=N2)N3C(=NC=C3NC(=O)C4=CC=CC=C4[N+](=O)[O-])C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC(=N2)N3C(=NC=C3NC(=O)C4=CC=CC=C4[N+](=O)[O-])C

InChI

InChI=1S/C22H19N5O4S/c1-3-31-16-10-8-15(9-11-16)18-13-32-22(24-18)26-14(2)23-12-20(26)25-21(28)17-6-4-5-7-19(17)27(29)30/h4-13H,3H2,1-2H3,(H,25,28)