N-(2-bromanyl-4-methyl-phenyl)-2-[4-[2-oxidanylidene-2-(prop-2-enylamino)ethyl]piperazin-1-yl]propanamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-2-[4-[2-oxidanylidene-2-(prop-2-enylamino)ethyl]piperazin-1-yl]propanamide Openeye Name: 2-[4-[2-(allylamino)-2-oxo-ethyl]piperazin-1-yl]-N-(2-bromo-4-methyl-phenyl)propanamide CAS Name: N-(2-bromo-4-methylphenyl)-2-[4-[2-oxo-2-(prop-2-enylamino)ethyl]-1-piperazinyl]propanamide IUPAC Name: N-(2-bromo-4-methylphenyl)-2-[4-[2-oxo-2-(prop-2-enylamino)ethyl]piperazin-1-yl]propanamide Traditional Name: 2-[4-[2-(allylamino)-2-keto-ethyl]piperazino]-N-(2-bromo-4-methyl-phenyl)propionamide Formula: C19H27BrN4O2 MolecularWeight: 423.34728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C)N2CCN(CC2)CC(=O)NCC=C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(C)N2CCN(CC2)CC(=O)NCC=C)Br

InChI

InChI=1S/C19H27BrN4O2/c1-4-7-21-18(25)13-23-8-10-24(11-9-23)15(3)19(26)22-17-6-5-14(2)12-16(17)20/h4-6,12,15H,1,7-11,13H2,2-3H3,(H,21,25)(H,22,26)