N-cyclopentyl-N-[[4-[(4-fluorophenyl)carbamothioyl]morpholin-2-yl]methyl]pyridine-3-carboxamide

Systemtic Name: N-cyclopentyl-N-[[4-[(4-fluorophenyl)carbamothioyl]morpholin-2-yl]methyl]pyridine-3-carboxamide Openeye Name: N-cyclopentyl-N-[[4-[(4-fluorophenyl)carbamothioyl]morpholin-2-yl]methyl]pyridine-3-carboxamide CAS Name: N-cyclopentyl-N-[[4-[(4-fluoroanilino)-sulfanylidenemethyl]-2-morpholinyl]methyl]-3-pyridinecarboxamide IUPAC Name: N-cyclopentyl-N-[[4-[(4-fluorophenyl)carbamothioyl]morpholin-2-yl]methyl]pyridine-3-carboxamide Traditional Name: N-cyclopentyl-N-[[4-[(4-fluorophenyl)thiocarbamoyl]morpholin-2-yl]methyl]nicotinamide Formula: C23H27FN4O2S MolecularWeight: 442.549483

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(CC2CN(CCO2)C(=S)NC3=CC=C(C=C3)F)C(=O)C4=CN=CC=C4

Isomeric SMILES

C1CCC(C1)N(CC2CN(CCO2)C(=S)NC3=CC=C(C=C3)F)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C23H27FN4O2S/c24-18-7-9-19(10-8-18)26-23(31)27-12-13-30-21(15-27)16-28(20-5-1-2-6-20)22(29)17-4-3-11-25-14-17/h3-4,7-11,14,20-21H,1-2,5-6,12-13,15-16H2,(H,26,31)