4-[(3,5-dimethyl-4-thiophen-2-yl-pyrazol-1-yl)-(3-hydroxyphenyl)methyl]-N,N-diethyl-benzamide

Systemtic Name: 4-[(3,5-dimethyl-4-thiophen-2-yl-pyrazol-1-yl)-(3-hydroxyphenyl)methyl]-N,N-diethyl-benzamide Openeye Name: 4-[[3,5-dimethyl-4-(2-thienyl)pyrazol-1-yl]-(3-hydroxyphenyl)methyl]-N,N-diethyl-benzamide CAS Name: 4-[(3,5-dimethyl-4-thiophen-2-yl-1-pyrazolyl)-(3-hydroxyphenyl)methyl]-N,N-diethylbenzamide IUPAC Name: 4-[(3,5-dimethyl-4-thiophen-2-ylpyrazol-1-yl)-(3-hydroxyphenyl)methyl]-N,N-diethylbenzamide Traditional Name: 4-[[3,5-dimethyl-4-(2-thienyl)pyrazol-1-yl]-(3-hydroxyphenyl)methyl]-N,N-diethyl-benzamide Formula: C27H29N3O2S MolecularWeight: 459.60306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)C(C2=CC(=CC=C2)O)N3C(=C(C(=N3)C)C4=CC=CS4)C

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)C(C2=CC(=CC=C2)O)N3C(=C(C(=N3)C)C4=CC=CS4)C

InChI

InChI=1S/C27H29N3O2S/c1-5-29(6-2)27(32)21-14-12-20(13-15-21)26(22-9-7-10-23(31)17-22)30-19(4)25(18(3)28-30)24-11-8-16-33-24/h7-17,26,31H,5-6H2,1-4H3