N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]ethanamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[(5-chloranylthiophen-2-yl)methyl-prop-2-enyl-amino]ethanamide Openeye Name: 2-[allyl-[(5-chloro-2-thienyl)methyl]amino]-N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)acetamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[(5-chloro-2-thiophenyl)methyl-prop-2-enylamino]acetamide IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[(5-chlorothiophen-2-yl)methyl-prop-2-enylamino]acetamide Traditional Name: 2-[allyl-[(5-chloro-2-thienyl)methyl]amino]-N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)acetamide Formula: C18H18BrClN2O3S MolecularWeight: 457.76912

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(CC1=CC=C(S1)Cl)CC(=O)NC2=CC3=C(C=C2Br)OCCO3

Isomeric SMILES

C=CCN(CC1=CC=C(S1)Cl)CC(=O)NC2=CC3=C(C=C2Br)OCCO3

InChI

InChI=1S/C18H18BrClN2O3S/c1-2-5-22(10-12-3-4-17(20)26-12)11-18(23)21-14-9-16-15(8-13(14)19)24-6-7-25-16/h2-4,8-9H,1,5-7,10-11H2,(H,21,23)