N-(2,6-diethylphenyl)-2-[2-(3,4-dimethoxyphenyl)sulfanylethanoyl]pyrazolidine-1-carboxamide

Systemtic Name: N-(2,6-diethylphenyl)-2-[2-(3,4-dimethoxyphenyl)sulfanylethanoyl]pyrazolidine-1-carboxamide Openeye Name: N-(2,6-diethylphenyl)-2-[2-(3,4-dimethoxyphenyl)sulfanylacetyl]pyrazolidine-1-carboxamide CAS Name: N-(2,6-diethylphenyl)-2-[2-[(3,4-dimethoxyphenyl)thio]-1-oxoethyl]-1-pyrazolidinecarboxamide IUPAC Name: N-(2,6-diethylphenyl)-2-[2-(3,4-dimethoxyphenyl)sulfanylacetyl]pyrazolidine-1-carboxamide Traditional Name: N-(2,6-diethylphenyl)-2-[2-[(3,4-dimethoxyphenyl)thio]acetyl]pyrazolidine-1-carboxamide Formula: C24H31N3O4S MolecularWeight: 457.58564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)N2CCCN2C(=O)CSC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)N2CCCN2C(=O)CSC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C24H31N3O4S/c1-5-17-9-7-10-18(6-2)23(17)25-24(29)27-14-8-13-26(27)22(28)16-32-19-11-12-20(30-3)21(15-19)31-4/h7,9-12,15H,5-6,8,13-14,16H2,1-4H3,(H,25,29)