8-[(8-methoxy-4-methyl-quinolin-2-yl)sulfanylmethyl]-4H-1,3-benzodioxin-6-amine

Systemtic Name: 8-[(8-methoxy-4-methyl-quinolin-2-yl)sulfanylmethyl]-4H-1,3-benzodioxin-6-amine Openeye Name: 8-[(8-methoxy-4-methyl-2-quinolyl)sulfanylmethyl]-4H-1,3-benzodioxin-6-amine CAS Name: 8-[[(8-methoxy-4-methyl-2-quinolinyl)thio]methyl]-4H-1,3-benzodioxin-6-amine IUPAC Name: 8-[(8-methoxy-4-methylquinolin-2-yl)sulfanylmethyl]-4H-1,3-benzodioxin-6-amine Traditional Name: [8-[[(8-methoxy-4-methyl-2-quinolyl)thio]methyl]-4H-1,3-benzodioxin-6-yl]amine Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C=CC=C2OC)SCC3=C4C(=CC(=C3)N)COCO4

Isomeric SMILES

CC1=CC(=NC2=C1C=CC=C2OC)SCC3=C4C(=CC(=C3)N)COCO4

InChI

InChI=1S/C20H20N2O3S/c1-12-6-18(22-19-16(12)4-3-5-17(19)23-2)26-10-14-8-15(21)7-13-9-24-11-25-20(13)14/h3-8H,9-11,21H2,1-2H3