(E)-3-(5-bromanyl-2-methoxy-phenyl)-N-[4-(4-butanoylpiperazin-1-yl)-3-chloranyl-phenyl]prop-2-enamide

Systemtic Name: (E)-3-(5-bromanyl-2-methoxy-phenyl)-N-[4-(4-butanoylpiperazin-1-yl)-3-chloranyl-phenyl]prop-2-enamide Openeye Name: (E)-3-(5-bromo-2-methoxy-phenyl)-N-[4-(4-butanoylpiperazin-1-yl)-3-chloro-phenyl]prop-2-enamide CAS Name: (E)-3-(5-bromo-2-methoxyphenyl)-N-[3-chloro-4-[4-(1-oxobutyl)-1-piperazinyl]phenyl]-2-propenamide IUPAC Name: (E)-3-(5-bromo-2-methoxyphenyl)-N-[4-(4-butanoylpiperazin-1-yl)-3-chlorophenyl]prop-2-enamide Traditional Name: (E)-3-(5-bromo-2-methoxy-phenyl)-N-[4-(4-butyrylpiperazino)-3-chloro-phenyl]acrylamide Formula: C24H27BrClN3O3 MolecularWeight: 520.84648

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C=CC3=C(C=CC(=C3)Br)OC)Cl

Isomeric SMILES

CCCC(=O)N1CCN(CC1)C2=C(C=C(C=C2)NC(=O)/C=C/C3=C(C=CC(=C3)Br)OC)Cl

InChI

InChI=1S/C24H27BrClN3O3/c1-3-4-24(31)29-13-11-28(12-14-29)21-8-7-19(16-20(21)26)27-23(30)10-5-17-15-18(25)6-9-22(17)32-2/h5-10,15-16H,3-4,11-14H2,1-2H3,(H,27,30)/b10-5+