8-methyl-N-[2-(4-methylsulfanylphenyl)ethyl]-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide

Systemtic Name: 8-methyl-N-[2-(4-methylsulfanylphenyl)ethyl]-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide Openeye Name: 8-methyl-N-[2-(4-methylsulfanylphenyl)ethyl]-4H-chromeno[3,4-d]isoxazole-3-carboxamide CAS Name: 8-methyl-N-[2-[4-(methylthio)phenyl]ethyl]-4H-[1]benzopyrano[3,4-d]isoxazole-3-carboxamide IUPAC Name: 8-methyl-N-[2-(4-methylsulfanylphenyl)ethyl]-4H-chromeno[3,4-d][1,2]oxazole-3-carboxamide Traditional Name: 8-methyl-N-[2-[4-(methylthio)phenyl]ethyl]-4H-chromen[3,4-d]isoxazole-3-carboxamide Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OCC3=C2ON=C3C(=O)NCCC4=CC=C(C=C4)SC

Isomeric SMILES

CC1=CC2=C(C=C1)OCC3=C2ON=C3C(=O)NCCC4=CC=C(C=C4)SC

InChI

InChI=1S/C21H20N2O3S/c1-13-3-8-18-16(11-13)20-17(12-25-18)19(23-26-20)21(24)22-10-9-14-4-6-15(27-2)7-5-14/h3-8,11H,9-10,12H2,1-2H3,(H,22,24)