N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-bromophenyl)carbamoyl-(2-morpholin-4-ylethyl)amino]-N-[(5-methylfuran-2-yl)methyl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-bromophenyl)carbamoyl-(2-morpholin-4-ylethyl)amino]-N-[(5-methylfuran-2-yl)methyl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-bromophenyl)carbamoyl-(2-morpholinoethyl)amino]-N-[(5-methyl-2-furyl)methyl]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[(2-bromoanilino)-oxomethyl]-[2-(4-morpholinyl)ethyl]amino]-N-[(5-methyl-2-furanyl)methyl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2-bromophenyl)carbamoyl-(2-morpholin-4-ylethyl)amino]-N-[(5-methylfuran-2-yl)methyl]acetamide Traditional Name: 2-[(2-bromophenyl)carbamoyl-(2-morpholinoethyl)amino]-N-[(5-methyl-2-furyl)methyl]-N-piperonyl-acetamide Formula: C29H33BrN4O6 MolecularWeight: 613.49952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CN(CC2=CC3=C(C=C2)OCO3)C(=O)CN(CCN4CCOCC4)C(=O)NC5=CC=CC=C5Br

Isomeric SMILES

CC1=CC=C(O1)CN(CC2=CC3=C(C=C2)OCO3)C(=O)CN(CCN4CCOCC4)C(=O)NC5=CC=CC=C5Br

InChI

InChI=1S/C29H33BrN4O6/c1-21-6-8-23(40-21)18-34(17-22-7-9-26-27(16-22)39-20-38-26)28(35)19-33(11-10-32-12-14-37-15-13-32)29(36)31-25-5-3-2-4-24(25)30/h2-9,16H,10-15,17-20H2,1H3,(H,31,36)