2-[(4-fluorophenyl)methylsulfanyl]-3-methyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide

Systemtic Name: 2-[(4-fluorophenyl)methylsulfanyl]-3-methyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide Openeye Name: 2-[(4-fluorophenyl)methylsulfanyl]-3-methyl-N-(2-morpholinoethyl)benzimidazole-5-carboxamide CAS Name: 2-[(4-fluorophenyl)methylthio]-3-methyl-N-[2-(4-morpholinyl)ethyl]-5-benzimidazolecarboxamide IUPAC Name: 2-[(4-fluorophenyl)methylsulfanyl]-3-methyl-N-(2-morpholin-4-ylethyl)benzimidazole-5-carboxamide Traditional Name: 2-[(4-fluorobenzyl)thio]-3-methyl-N-(2-morpholinoethyl)benzimidazole-5-carboxamide Formula: C22H25FN4O2S MolecularWeight: 428.522903

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)C(=O)NCCN3CCOCC3)N=C1SCC4=CC=C(C=C4)F

Isomeric SMILES

CN1C2=C(C=CC(=C2)C(=O)NCCN3CCOCC3)N=C1SCC4=CC=C(C=C4)F

InChI

InChI=1S/C22H25FN4O2S/c1-26-20-14-17(21(28)24-8-9-27-10-12-29-13-11-27)4-7-19(20)25-22(26)30-15-16-2-5-18(23)6-3-16/h2-7,14H,8-13,15H2,1H3,(H,24,28)