2-[4-[2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]-N-prop-2-enyl-ethanamide

Systemtic Name: 2-[4-[2-[(4-bromanyl-3-methyl-phenyl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]-N-prop-2-enyl-ethanamide Openeye Name: N-allyl-2-[4-[2-(4-bromo-3-methyl-anilino)-2-oxo-ethyl]piperazin-1-yl]acetamide CAS Name: 2-[4-[2-(4-bromo-3-methylanilino)-2-oxoethyl]-1-piperazinyl]-N-prop-2-enylacetamide IUPAC Name: 2-[4-[2-(4-bromo-3-methylanilino)-2-oxoethyl]piperazin-1-yl]-N-prop-2-enylacetamide Traditional Name: N-allyl-2-[4-[2-(4-bromo-3-methyl-anilino)-2-keto-ethyl]piperazino]acetamide Formula: C18H25BrN4O2 MolecularWeight: 409.3207

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CN2CCN(CC2)CC(=O)NCC=C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CN2CCN(CC2)CC(=O)NCC=C)Br

InChI

InChI=1S/C18H25BrN4O2/c1-3-6-20-17(24)12-22-7-9-23(10-8-22)13-18(25)21-15-4-5-16(19)14(2)11-15/h3-5,11H,1,6-10,12-13H2,2H3,(H,20,24)(H,21,25)