2-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-ethyl-amino]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-ethyl-amino]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-ethyl-amino]-N-(2-thienylmethyl)acetamide CAS Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-ethylamino]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-ethylamino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl-ethyl-amino]-N-(2-thenyl)acetamide Formula: C18H21BrN2O3S MolecularWeight: 425.33994

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1Br)OCCO2)CC(=O)NCC3=CC=CS3

Isomeric SMILES

CCN(CC1=CC2=C(C=C1Br)OCCO2)CC(=O)NCC3=CC=CS3

InChI

InChI=1S/C18H21BrN2O3S/c1-2-21(12-18(22)20-10-14-4-3-7-25-14)11-13-8-16-17(9-15(13)19)24-6-5-23-16/h3-4,7-9H,2,5-6,10-12H2,1H3,(H,20,22)