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

Systemtic Name: 4-[(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]thiophene-2-carboxamide Openeye Name: 4-[(4-chloro-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[4-(1-piperidylmethyl)phenyl]thiophene-2-carboxamide CAS Name: 4-[(4-chloro-3,5-dimethyl-1-pyrazolyl)methyl]-N-[4-(1-piperidinylmethyl)phenyl]-2-thiophenecarboxamide IUPAC Name: 4-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]thiophene-2-carboxamide Traditional Name: 4-[(4-chloro-3,5-dimethyl-pyrazol-1-yl)methyl]-N-[4-(piperidinomethyl)phenyl]thiophene-2-carboxamide Formula: C23H27ClN4OS MolecularWeight: 443.00468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CSC(=C2)C(=O)NC3=CC=C(C=C3)CN4CCCCC4)C)Cl

Isomeric SMILES

CC1=C(C(=NN1CC2=CSC(=C2)C(=O)NC3=CC=C(C=C3)CN4CCCCC4)C)Cl

InChI

InChI=1S/C23H27ClN4OS/c1-16-22(24)17(2)28(26-16)14-19-12-21(30-15-19)23(29)25-20-8-6-18(7-9-20)13-27-10-4-3-5-11-27/h6-9,12,15H,3-5,10-11,13-14H2,1-2H3,(H,25,29)