4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]thiophene-2-carboxamide

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]thiophene-2-carboxamide Openeye Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[4-(1-piperidylmethyl)phenyl]thiophene-2-carboxamide CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-[4-(1-piperidinylmethyl)phenyl]-2-thiophenecarboxamide IUPAC Name: 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]thiophene-2-carboxamide Traditional Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[4-(piperidinomethyl)phenyl]thiophene-2-carboxamide Formula: C23H27N5O3S MolecularWeight: 453.55718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CSC(=C2)C(=O)NC3=CC=C(C=C3)CN4CCCCC4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CSC(=C2)C(=O)NC3=CC=C(C=C3)CN4CCCCC4)C)[N+](=O)[O-]

InChI

InChI=1S/C23H27N5O3S/c1-16-22(28(30)31)17(2)27(25-16)14-19-12-21(32-15-19)23(29)24-20-8-6-18(7-9-20)13-26-10-4-3-5-11-26/h6-9,12,15H,3-5,10-11,13-14H2,1-2H3,(H,24,29)