N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-2-methylsulfanyl-3-phenyl-imidazole-4-carboxamide

Systemtic Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-2-methylsulfanyl-3-phenyl-imidazole-4-carboxamide Openeye Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-2-methylsulfanyl-3-phenyl-imidazole-4-carboxamide CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-2-(methylthio)-3-phenyl-4-imidazolecarboxamide IUPAC Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-2-methylsulfanyl-3-phenylimidazole-4-carboxamide Traditional Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-N-methyl-2-(methylthio)-3-phenyl-imidazole-4-carboxamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1COC2=CC=CC=C2O1)C(=O)C3=CN=C(N3C4=CC=CC=C4)SC

Isomeric SMILES

CN(C[C@H]1COC2=CC=CC=C2O1)C(=O)C3=CN=C(N3C4=CC=CC=C4)SC

InChI

InChI=1S/C21H21N3O3S/c1-23(13-16-14-26-18-10-6-7-11-19(18)27-16)20(25)17-12-22-21(28-2)24(17)15-8-4-3-5-9-15/h3-12,16H,13-14H2,1-2H3/t16-/m0/s1