N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[2-(2-methyl-1H-indol-3-yl)ethanoyl]pyrazolidine-1-carbothioamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[2-(2-methyl-1H-indol-3-yl)ethanoyl]pyrazolidine-1-carbothioamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[2-(2-methyl-1H-indol-3-yl)acetyl]pyrazolidine-1-carbothioamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[2-(2-methyl-1H-indol-3-yl)-1-oxoethyl]-1-pyrazolidinecarbothioamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-[2-(2-methyl-1H-indol-3-yl)acetyl]pyrazolidine-1-carbothioamide Traditional Name: N-homoveratryl-2-[2-(2-methyl-1H-indol-3-yl)acetyl]pyrazolidine-1-carbothioamide Formula: C25H30N4O3S MolecularWeight: 466.5957

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)CC(=O)N3CCCN3C(=S)NCCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)CC(=O)N3CCCN3C(=S)NCCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C25H30N4O3S/c1-17-20(19-7-4-5-8-21(19)27-17)16-24(30)28-13-6-14-29(28)25(33)26-12-11-18-9-10-22(31-2)23(15-18)32-3/h4-5,7-10,15,27H,6,11-14,16H2,1-3H3,(H,26,33)