1-(2-cyanoethyl)-N-(4-methyl-2-nitro-phenyl)-3-thiophen-2-yl-pyrazole-4-carboxamide

Systemtic Name: 1-(2-cyanoethyl)-N-(4-methyl-2-nitro-phenyl)-3-thiophen-2-yl-pyrazole-4-carboxamide Openeye Name: 1-(2-cyanoethyl)-N-(4-methyl-2-nitro-phenyl)-3-(2-thienyl)pyrazole-4-carboxamide CAS Name: 1-(2-cyanoethyl)-N-(4-methyl-2-nitrophenyl)-3-thiophen-2-yl-4-pyrazolecarboxamide IUPAC Name: 1-(2-cyanoethyl)-N-(4-methyl-2-nitrophenyl)-3-thiophen-2-ylpyrazole-4-carboxamide Traditional Name: 1-(2-cyanoethyl)-N-(4-methyl-2-nitro-phenyl)-3-(2-thienyl)pyrazole-4-carboxamide Formula: C18H15N5O3S MolecularWeight: 381.4084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C2=CN(N=C2C3=CC=CS3)CCC#N)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C2=CN(N=C2C3=CC=CS3)CCC#N)[N+](=O)[O-]

InChI

InChI=1S/C18H15N5O3S/c1-12-5-6-14(15(10-12)23(25)26)20-18(24)13-11-22(8-3-7-19)21-17(13)16-4-2-9-27-16/h2,4-6,9-11H,3,8H2,1H3,(H,20,24)