2-(4-chloranyl-2-methyl-phenoxy)-N-[(3-chloranyl-4-pyrrolidin-1-yl-phenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(4-chloranyl-2-methyl-phenoxy)-N-[(3-chloranyl-4-pyrrolidin-1-yl-phenyl)carbamothioyl]ethanamide Openeye Name: 2-(4-chloro-2-methyl-phenoxy)-N-[(3-chloro-4-pyrrolidin-1-yl-phenyl)carbamothioyl]acetamide CAS Name: 2-(4-chloro-2-methylphenoxy)-N-[[3-chloro-4-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-chloro-2-methylphenoxy)-N-[(3-chloro-4-pyrrolidin-1-ylphenyl)carbamothioyl]acetamide Traditional Name: 2-(4-chloro-2-methyl-phenoxy)-N-[(3-chloro-4-pyrrolidino-phenyl)thiocarbamoyl]acetamide Formula: C20H21Cl2N3O2S MolecularWeight: 438.37064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCC(=O)NC(=S)NC2=CC(=C(C=C2)N3CCCC3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCC(=O)NC(=S)NC2=CC(=C(C=C2)N3CCCC3)Cl

InChI

InChI=1S/C20H21Cl2N3O2S/c1-13-10-14(21)4-7-18(13)27-12-19(26)24-20(28)23-15-5-6-17(16(22)11-15)25-8-2-3-9-25/h4-7,10-11H,2-3,8-9,12H2,1H3,(H2,23,24,26,28)