2-[2,4-bis(chloranyl)phenoxy]-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]propanamide

Systemtic Name: 2-[2,4-bis(chloranyl)phenoxy]-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]propanamide Openeye Name: 2-(2,4-dichlorophenoxy)-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]propanamide CAS Name: 2-(2,4-dichlorophenoxy)-N-[[2-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]propanamide IUPAC Name: 2-(2,4-dichlorophenoxy)-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]propanamide Traditional Name: 2-(2,4-dichlorophenoxy)-N-[(2-pyrrolidinophenyl)thiocarbamoyl]propionamide Formula: C20H21Cl2N3O2S MolecularWeight: 438.37064

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=S)NC1=CC=CC=C1N2CCCC2)OC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC(C(=O)NC(=S)NC1=CC=CC=C1N2CCCC2)OC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H21Cl2N3O2S/c1-13(27-18-9-8-14(21)12-15(18)22)19(26)24-20(28)23-16-6-2-3-7-17(16)25-10-4-5-11-25/h2-3,6-9,12-13H,4-5,10-11H2,1H3,(H2,23,24,26,28)