N-[4-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-1,3-thiazol-2-yl]-4-nitro-benzamide

Systemtic Name: N-[4-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]-1,3-thiazol-2-yl]-4-nitro-benzamide Openeye Name: N-[4-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]thiazol-2-yl]-4-nitro-benzamide CAS Name: N-[4-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-3-pyrrolyl]-2-thiazolyl]-4-nitrobenzamide IUPAC Name: N-[4-[1-(1,3-benzodioxol-5-yl)-2,5-dimethylpyrrol-3-yl]-1,3-thiazol-2-yl]-4-nitrobenzamide Traditional Name: N-[4-[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]thiazol-2-yl]-4-nitro-benzamide Formula: C23H18N4O5S MolecularWeight: 462.47782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC3=C(C=C2)OCO3)C)C4=CSC(=N4)NC(=O)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1C2=CC3=C(C=C2)OCO3)C)C4=CSC(=N4)NC(=O)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H18N4O5S/c1-13-9-18(14(2)26(13)17-7-8-20-21(10-17)32-12-31-20)19-11-33-23(24-19)25-22(28)15-3-5-16(6-4-15)27(29)30/h3-11H,12H2,1-2H3,(H,24,25,28)