2-[[2-[(5-bromanylthiophen-2-yl)methyl-prop-2-enyl-amino]-2-oxidanylidene-ethyl]-propyl-amino]-N-(2-methoxyphenyl)ethanamide

Systemtic Name: 2-[[2-[(5-bromanylthiophen-2-yl)methyl-prop-2-enyl-amino]-2-oxidanylidene-ethyl]-propyl-amino]-N-(2-methoxyphenyl)ethanamide Openeye Name: 2-[[2-[allyl-[(5-bromo-2-thienyl)methyl]amino]-2-oxo-ethyl]-propyl-amino]-N-(2-methoxyphenyl)acetamide CAS Name: 2-[[2-[(5-bromo-2-thiophenyl)methyl-prop-2-enylamino]-2-oxoethyl]-propylamino]-N-(2-methoxyphenyl)acetamide IUPAC Name: 2-[[2-[(5-bromothiophen-2-yl)methyl-prop-2-enylamino]-2-oxoethyl]-propylamino]-N-(2-methoxyphenyl)acetamide Traditional Name: 2-[[2-[allyl-[(5-bromo-2-thienyl)methyl]amino]-2-keto-ethyl]-propyl-amino]-N-(2-methoxyphenyl)acetamide Formula: C22H28BrN3O3S MolecularWeight: 494.44502

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)NC1=CC=CC=C1OC)CC(=O)N(CC=C)CC2=CC=C(S2)Br

Isomeric SMILES

CCCN(CC(=O)NC1=CC=CC=C1OC)CC(=O)N(CC=C)CC2=CC=C(S2)Br

InChI

InChI=1S/C22H28BrN3O3S/c1-4-12-25(15-21(27)24-18-8-6-7-9-19(18)29-3)16-22(28)26(13-5-2)14-17-10-11-20(23)30-17/h5-11H,2,4,12-16H2,1,3H3,(H,24,27)