N-(4-chloranyl-2-nitro-phenyl)-4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]thiophene-2-carboxamide

Systemtic Name: N-(4-chloranyl-2-nitro-phenyl)-4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]thiophene-2-carboxamide Openeye Name: N-(4-chloro-2-nitro-phenyl)-4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]thiophene-2-carboxamide CAS Name: N-(4-chloro-2-nitrophenyl)-4-[(5-methyl-3-nitro-1-pyrazolyl)methyl]-2-thiophenecarboxamide IUPAC Name: N-(4-chloro-2-nitrophenyl)-4-[(5-methyl-3-nitropyrazol-1-yl)methyl]thiophene-2-carboxamide Traditional Name: N-(4-chloro-2-nitro-phenyl)-4-[(5-methyl-3-nitro-pyrazol-1-yl)methyl]thiophene-2-carboxamide Formula: C16H12ClN5O5S MolecularWeight: 421.81498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC2=CSC(=C2)C(=O)NC3=C(C=C(C=C3)Cl)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1CC2=CSC(=C2)C(=O)NC3=C(C=C(C=C3)Cl)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H12ClN5O5S/c1-9-4-15(22(26)27)19-20(9)7-10-5-14(28-8-10)16(23)18-12-3-2-11(17)6-13(12)21(24)25/h2-6,8H,7H2,1H3,(H,18,23)