3-(cyclohexylsulfanylmethyl)-N-(2-morpholin-4-ylcarbonylphenyl)-1-benzofuran-2-carboxamide

Systemtic Name: 3-(cyclohexylsulfanylmethyl)-N-(2-morpholin-4-ylcarbonylphenyl)-1-benzofuran-2-carboxamide Openeye Name: 3-(cyclohexylsulfanylmethyl)-N-[2-(morpholine-4-carbonyl)phenyl]benzofuran-2-carboxamide CAS Name: 3-[(cyclohexylthio)methyl]-N-[2-[4-morpholinyl(oxo)methyl]phenyl]-2-benzofurancarboxamide IUPAC Name: 3-(cyclohexylsulfanylmethyl)-N-[2-(morpholine-4-carbonyl)phenyl]-1-benzofuran-2-carboxamide Traditional Name: 3-[(cyclohexylthio)methyl]-N-[2-(morpholine-4-carbonyl)phenyl]coumarilamide Formula: C27H30N2O4S MolecularWeight: 478.6031

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)SCC2=C(OC3=CC=CC=C32)C(=O)NC4=CC=CC=C4C(=O)N5CCOCC5

Isomeric SMILES

C1CCC(CC1)SCC2=C(OC3=CC=CC=C32)C(=O)NC4=CC=CC=C4C(=O)N5CCOCC5

InChI

InChI=1S/C27H30N2O4S/c30-26(28-23-12-6-4-11-21(23)27(31)29-14-16-32-17-15-29)25-22(18-34-19-8-2-1-3-9-19)20-10-5-7-13-24(20)33-25/h4-7,10-13,19H,1-3,8-9,14-18H2,(H,28,30)