(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(3-methoxyphenyl)pyrrolidine-1-carbothioamide

Systemtic Name: (2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(3-methoxyphenyl)pyrrolidine-1-carbothioamide Openeye Name: (2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(3-methoxyphenyl)pyrrolidine-1-carbothioamide CAS Name: (2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(3-methoxyphenyl)-1-pyrrolidinecarbothioamide IUPAC Name: (2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(3-methoxyphenyl)pyrrolidine-1-carbothioamide Traditional Name: (2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(3-methoxyphenyl)pyrrolidine-1-carbothioamide Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)N2CCCC2C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)N2CCC[C@@H]2C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C20H22N2O3S/c1-23-16-5-2-4-15(13-16)21-20(26)22-9-3-6-17(22)14-7-8-18-19(12-14)25-11-10-24-18/h2,4-5,7-8,12-13,17H,3,6,9-11H2,1H3,(H,21,26)/t17-/m1/s1