(2R)-2-(4-ethoxyphenyl)-N-(4-nitrophenyl)pyrrolidine-1-carbothioamide

Systemtic Name: (2R)-2-(4-ethoxyphenyl)-N-(4-nitrophenyl)pyrrolidine-1-carbothioamide Openeye Name: (2R)-2-(4-ethoxyphenyl)-N-(4-nitrophenyl)pyrrolidine-1-carbothioamide CAS Name: (2R)-2-(4-ethoxyphenyl)-N-(4-nitrophenyl)-1-pyrrolidinecarbothioamide IUPAC Name: (2R)-2-(4-ethoxyphenyl)-N-(4-nitrophenyl)pyrrolidine-1-carbothioamide Traditional Name: (2R)-N-(4-nitrophenyl)-2-p-phenetyl-pyrrolidine-1-carbothioamide Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CCCN2C(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@H]2CCCN2C(=S)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O3S/c1-2-25-17-11-5-14(6-12-17)18-4-3-13-21(18)19(26)20-15-7-9-16(10-8-15)22(23)24/h5-12,18H,2-4,13H2,1H3,(H,20,26)/t18-/m1/s1