5-tert-butyl-N-[(5-chloranyl-1-benzothiophen-3-yl)methyl]-2-(phenylmethyl)pyrazole-3-carboxamide

Systemtic Name: 5-tert-butyl-N-[(5-chloranyl-1-benzothiophen-3-yl)methyl]-2-(phenylmethyl)pyrazole-3-carboxamide Openeye Name: 2-benzyl-5-tert-butyl-N-[(5-chlorobenzothiophen-3-yl)methyl]pyrazole-3-carboxamide CAS Name: 5-tert-butyl-N-[(5-chloro-1-benzothiophen-3-yl)methyl]-2-(phenylmethyl)-3-pyrazolecarboxamide IUPAC Name: 2-benzyl-5-tert-butyl-N-[(5-chloro-1-benzothiophen-3-yl)methyl]pyrazole-3-carboxamide Traditional Name: 2-benzyl-5-tert-butyl-N-[(5-chlorobenzothiophen-3-yl)methyl]pyrazole-3-carboxamide Formula: C24H24ClN3OS MolecularWeight: 437.98486

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C(=O)NCC2=CSC3=C2C=C(C=C3)Cl)CC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C(=O)NCC2=CSC3=C2C=C(C=C3)Cl)CC4=CC=CC=C4

InChI

InChI=1S/C24H24ClN3OS/c1-24(2,3)22-12-20(28(27-22)14-16-7-5-4-6-8-16)23(29)26-13-17-15-30-21-10-9-18(25)11-19(17)21/h4-12,15H,13-14H2,1-3H3,(H,26,29)