N-cyclopentyl-N-[[4-[(4-fluorophenyl)carbamothioyl]morpholin-2-yl]methyl]-4-methyl-benzamide

Systemtic Name: N-cyclopentyl-N-[[4-[(4-fluorophenyl)carbamothioyl]morpholin-2-yl]methyl]-4-methyl-benzamide Openeye Name: N-cyclopentyl-N-[[4-[(4-fluorophenyl)carbamothioyl]morpholin-2-yl]methyl]-4-methyl-benzamide CAS Name: N-cyclopentyl-N-[[4-[(4-fluoroanilino)-sulfanylidenemethyl]-2-morpholinyl]methyl]-4-methylbenzamide IUPAC Name: N-cyclopentyl-N-[[4-[(4-fluorophenyl)carbamothioyl]morpholin-2-yl]methyl]-4-methylbenzamide Traditional Name: N-cyclopentyl-N-[[4-[(4-fluorophenyl)thiocarbamoyl]morpholin-2-yl]methyl]-4-methyl-benzamide Formula: C25H30FN3O2S MolecularWeight: 455.588003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(CC2CN(CCO2)C(=S)NC3=CC=C(C=C3)F)C4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(CC2CN(CCO2)C(=S)NC3=CC=C(C=C3)F)C4CCCC4

InChI

InChI=1S/C25H30FN3O2S/c1-18-6-8-19(9-7-18)24(30)29(22-4-2-3-5-22)17-23-16-28(14-15-31-23)25(32)27-21-12-10-20(26)11-13-21/h6-13,22-23H,2-5,14-17H2,1H3,(H,27,32)