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

Systemtic Name: N-[2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-5-methyl-pyrazol-3-yl]-2-methyl-3-nitro-benzamide Openeye Name: N-[2-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-5-methyl-pyrazol-3-yl]-2-methyl-3-nitro-benzamide CAS Name: N-[2-[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]-5-methyl-3-pyrazolyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-yl]-2-methyl-3-nitrobenzamide Traditional Name: N-[2-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-5-methyl-pyrazol-3-yl]-2-methyl-3-nitro-benzamide Formula: C22H17N5O5S MolecularWeight: 463.46588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C)C3=NC(=CS3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C)C3=NC(=CS3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H17N5O5S/c1-12-8-20(24-21(28)15-4-3-5-17(13(15)2)27(29)30)26(25-12)22-23-16(10-33-22)14-6-7-18-19(9-14)32-11-31-18/h3-10H,11H2,1-2H3,(H,24,28)