4-[(4-chloranylpyrazol-1-yl)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]thiophene-2-carboxamide

Systemtic Name: 4-[(4-chloranylpyrazol-1-yl)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]thiophene-2-carboxamide Openeye Name: 4-[(4-chloropyrazol-1-yl)methyl]-N-[4-(1-piperidylmethyl)phenyl]thiophene-2-carboxamide CAS Name: 4-[(4-chloro-1-pyrazolyl)methyl]-N-[4-(1-piperidinylmethyl)phenyl]-2-thiophenecarboxamide IUPAC Name: 4-[(4-chloropyrazol-1-yl)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]thiophene-2-carboxamide Traditional Name: 4-[(4-chloropyrazol-1-yl)methyl]-N-[4-(piperidinomethyl)phenyl]thiophene-2-carboxamide Formula: C21H23ClN4OS MolecularWeight: 414.95152

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C3=CC(=CS3)CN4C=C(C=N4)Cl

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C3=CC(=CS3)CN4C=C(C=N4)Cl

InChI

InChI=1S/C21H23ClN4OS/c22-18-11-23-26(14-18)13-17-10-20(28-15-17)21(27)24-19-6-4-16(5-7-19)12-25-8-2-1-3-9-25/h4-7,10-11,14-15H,1-3,8-9,12-13H2,(H,24,27)