N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-[(7-methylsulfanyl-2-morpholin-4-yl-quinolin-3-yl)methyl]-2-thiophen-3-yl-ethanamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-[(7-methylsulfanyl-2-morpholin-4-yl-quinolin-3-yl)methyl]-2-thiophen-3-yl-ethanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-[(7-methylsulfanyl-2-morpholino-3-quinolyl)methyl]-2-(3-thienyl)acetamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-[[7-(methylthio)-2-(4-morpholinyl)-3-quinolinyl]methyl]-2-(3-thiophenyl)acetamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-[(7-methylsulfanyl-2-morpholin-4-ylquinolin-3-yl)methyl]-2-thiophen-3-ylacetamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-3-ylmethyl)-N-[[7-(methylthio)-2-morpholino-3-quinolyl]methyl]-2-(3-thienyl)acetamide Formula: C30H31N3O4S2 MolecularWeight: 561.71484

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=NC(=C(C=C2C=C1)CN(CC3COC4=CC=CC=C4O3)C(=O)CC5=CSC=C5)N6CCOCC6

Isomeric SMILES

CSC1=CC2=NC(=C(C=C2C=C1)CN(CC3COC4=CC=CC=C4O3)C(=O)CC5=CSC=C5)N6CCOCC6

InChI

InChI=1S/C30H31N3O4S2/c1-38-25-7-6-22-15-23(30(31-26(22)16-25)32-9-11-35-12-10-32)17-33(29(34)14-21-8-13-39-20-21)18-24-19-36-27-4-2-3-5-28(27)37-24/h2-8,13,15-16,20,24H,9-12,14,17-19H2,1H3