4-[(4-chloranyl-3-methyl-phenoxy)methyl]-N-[1-(phenylmethyl)pyrazol-4-yl]thiophene-2-carboxamide

Systemtic Name: 4-[(4-chloranyl-3-methyl-phenoxy)methyl]-N-[1-(phenylmethyl)pyrazol-4-yl]thiophene-2-carboxamide Openeye Name: N-(1-benzylpyrazol-4-yl)-4-[(4-chloro-3-methyl-phenoxy)methyl]thiophene-2-carboxamide CAS Name: 4-[(4-chloro-3-methylphenoxy)methyl]-N-[1-(phenylmethyl)-4-pyrazolyl]-2-thiophenecarboxamide IUPAC Name: N-(1-benzylpyrazol-4-yl)-4-[(4-chloro-3-methylphenoxy)methyl]thiophene-2-carboxamide Traditional Name: N-(1-benzylpyrazol-4-yl)-4-[(4-chloro-3-methyl-phenoxy)methyl]thiophene-2-carboxamide Formula: C23H20ClN3O2S MolecularWeight: 437.9418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=CSC(=C2)C(=O)NC3=CN(N=C3)CC4=CC=CC=C4)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=CSC(=C2)C(=O)NC3=CN(N=C3)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C23H20ClN3O2S/c1-16-9-20(7-8-21(16)24)29-14-18-10-22(30-15-18)23(28)26-19-11-25-27(13-19)12-17-5-3-2-4-6-17/h2-11,13,15H,12,14H2,1H3,(H,26,28)