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

Systemtic Name: N-[2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-5-methyl-pyrazol-3-yl]-3-nitro-benzamide Openeye Name: N-[2-[4-(4-chlorophenyl)thiazol-2-yl]-5-methyl-pyrazol-3-yl]-3-nitro-benzamide CAS Name: N-[2-[4-(4-chlorophenyl)-2-thiazolyl]-5-methyl-3-pyrazolyl]-3-nitrobenzamide IUPAC Name: N-[2-[4-(4-chlorophenyl)-1,3-thiazol-2-yl]-5-methylpyrazol-3-yl]-3-nitrobenzamide Traditional Name: N-[2-[4-(4-chlorophenyl)thiazol-2-yl]-5-methyl-pyrazol-3-yl]-3-nitro-benzamide Formula: C20H14ClN5O3S MolecularWeight: 439.87486

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H14ClN5O3S/c1-12-9-18(23-19(27)14-3-2-4-16(10-14)26(28)29)25(24-12)20-22-17(11-30-20)13-5-7-15(21)8-6-13/h2-11H,1H3,(H,23,27)