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

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(4-methyl-1,3-thiazol-2-yl)-N-phenyl-benzamide Openeye Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(4-methylthiazol-2-yl)-N-phenyl-benzamide CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-(4-methyl-2-thiazolyl)-N-phenylbenzamide IUPAC Name: 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylbenzamide Traditional Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(4-methylthiazol-2-yl)-N-phenyl-benzamide Formula: C23H21N5O3S MolecularWeight: 447.50954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)N(C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)CN4C(=C(C(=N4)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CSC(=N1)N(C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)CN4C(=C(C(=N4)C)[N+](=O)[O-])C

InChI

InChI=1S/C23H21N5O3S/c1-15-14-32-23(24-15)27(20-7-5-4-6-8-20)22(29)19-11-9-18(10-12-19)13-26-17(3)21(28(30)31)16(2)25-26/h4-12,14H,13H2,1-3H3