4-[(5-chloranyl-1-benzothiophen-3-yl)methyl]-N,3,5-trimethyl-pyrazole-1-carboxamide

Systemtic Name: 4-[(5-chloranyl-1-benzothiophen-3-yl)methyl]-N,3,5-trimethyl-pyrazole-1-carboxamide Openeye Name: 4-[(5-chlorobenzothiophen-3-yl)methyl]-N,3,5-trimethyl-pyrazole-1-carboxamide CAS Name: 4-[(5-chloro-1-benzothiophen-3-yl)methyl]-N,3,5-trimethyl-1-pyrazolecarboxamide IUPAC Name: 4-[(5-chloro-1-benzothiophen-3-yl)methyl]-N,3,5-trimethylpyrazole-1-carboxamide Traditional Name: 4-[(5-chlorobenzothiophen-3-yl)methyl]-N,3,5-trimethyl-pyrazole-1-carboxamide Formula: C16H16ClN3OS MolecularWeight: 333.83574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)NC)C)CC2=CSC3=C2C=C(C=C3)Cl

Isomeric SMILES

CC1=C(C(=NN1C(=O)NC)C)CC2=CSC3=C2C=C(C=C3)Cl

InChI

InChI=1S/C16H16ClN3OS/c1-9-13(10(2)20(19-9)16(21)18-3)6-11-8-22-15-5-4-12(17)7-14(11)15/h4-5,7-8H,6H2,1-3H3,(H,18,21)