2-(3-chloranyl-2,6-dimethoxy-phenyl)carbonyl-N-prop-2-enyl-pyrazolidine-1-carbothioamide

Systemtic Name: 2-(3-chloranyl-2,6-dimethoxy-phenyl)carbonyl-N-prop-2-enyl-pyrazolidine-1-carbothioamide Openeye Name: N-allyl-2-(3-chloro-2,6-dimethoxy-benzoyl)pyrazolidine-1-carbothioamide CAS Name: 2-[(3-chloro-2,6-dimethoxyphenyl)-oxomethyl]-N-prop-2-enyl-1-pyrazolidinecarbothioamide IUPAC Name: 2-(3-chloro-2,6-dimethoxybenzoyl)-N-prop-2-enylpyrazolidine-1-carbothioamide Traditional Name: N-allyl-2-(3-chloro-2,6-dimethoxy-benzoyl)pyrazolidine-1-carbothioamide Formula: C16H20ClN3O3S MolecularWeight: 369.8663

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)Cl)OC)C(=O)N2CCCN2C(=S)NCC=C

Isomeric SMILES

COC1=C(C(=C(C=C1)Cl)OC)C(=O)N2CCCN2C(=S)NCC=C

InChI

InChI=1S/C16H20ClN3O3S/c1-4-8-18-16(24)20-10-5-9-19(20)15(21)13-12(22-2)7-6-11(17)14(13)23-3/h4,6-7H,1,5,8-10H2,2-3H3,(H,18,24)