N-(3-chlorophenyl)-2-(3,4-dimethoxyphenyl)pyrrolidine-1-carbothioamide

Systemtic Name: N-(3-chlorophenyl)-2-(3,4-dimethoxyphenyl)pyrrolidine-1-carbothioamide Openeye Name: N-(3-chlorophenyl)-2-(3,4-dimethoxyphenyl)pyrrolidine-1-carbothioamide CAS Name: N-(3-chlorophenyl)-2-(3,4-dimethoxyphenyl)-1-pyrrolidinecarbothioamide IUPAC Name: N-(3-chlorophenyl)-2-(3,4-dimethoxyphenyl)pyrrolidine-1-carbothioamide Traditional Name: N-(3-chlorophenyl)-2-(3,4-dimethoxyphenyl)pyrrolidine-1-carbothioamide Formula: C19H21ClN2O2S MolecularWeight: 376.90024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CCCN2C(=S)NC3=CC(=CC=C3)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CCCN2C(=S)NC3=CC(=CC=C3)Cl)OC

InChI

InChI=1S/C19H21ClN2O2S/c1-23-17-9-8-13(11-18(17)24-2)16-7-4-10-22(16)19(25)21-15-6-3-5-14(20)12-15/h3,5-6,8-9,11-12,16H,4,7,10H2,1-2H3,(H,21,25)