N-(2,5-dimethylphenyl)-3-phenyl-pyrrolidine-1-carbothioamide

Systemtic Name: N-(2,5-dimethylphenyl)-3-phenyl-pyrrolidine-1-carbothioamide Openeye Name: N-(2,5-dimethylphenyl)-3-phenyl-pyrrolidine-1-carbothioamide CAS Name: N-(2,5-dimethylphenyl)-3-phenyl-1-pyrrolidinecarbothioamide IUPAC Name: N-(2,5-dimethylphenyl)-3-phenylpyrrolidine-1-carbothioamide Traditional Name: N-(2,5-dimethylphenyl)-3-phenyl-pyrrolidine-1-carbothioamide Formula: C19H22N2S MolecularWeight: 310.45638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)N2CCC(C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)N2CCC(C2)C3=CC=CC=C3

InChI

InChI=1S/C19H22N2S/c1-14-8-9-15(2)18(12-14)20-19(22)21-11-10-17(13-21)16-6-4-3-5-7-16/h3-9,12,17H,10-11,13H2,1-2H3,(H,20,22)