2-[3-(2,5-dimethoxyphenyl)prop-2-enoyl]-N-methyl-pyrazolidine-1-carbothioamide

Systemtic Name: 2-[3-(2,5-dimethoxyphenyl)prop-2-enoyl]-N-methyl-pyrazolidine-1-carbothioamide Openeye Name: 2-[3-(2,5-dimethoxyphenyl)prop-2-enoyl]-N-methyl-pyrazolidine-1-carbothioamide CAS Name: 2-[3-(2,5-dimethoxyphenyl)-1-oxoprop-2-enyl]-N-methyl-1-pyrazolidinecarbothioamide IUPAC Name: 2-[3-(2,5-dimethoxyphenyl)prop-2-enoyl]-N-methylpyrazolidine-1-carbothioamide Traditional Name: 2-[3-(2,5-dimethoxyphenyl)acryloyl]-N-methyl-pyrazolidine-1-carbothioamide Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N1CCCN1C(=O)C=CC2=C(C=CC(=C2)OC)OC

Isomeric SMILES

CNC(=S)N1CCCN1C(=O)C=CC2=C(C=CC(=C2)OC)OC

InChI

InChI=1S/C16H21N3O3S/c1-17-16(23)19-10-4-9-18(19)15(20)8-5-12-11-13(21-2)6-7-14(12)22-3/h5-8,11H,4,9-10H2,1-3H3,(H,17,23)