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

Systemtic Name: (E)-3-(5-bromanyl-2-methoxy-phenyl)-N-[4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)phenyl]prop-2-enamide Openeye Name: (E)-3-(5-bromo-2-methoxy-phenyl)-N-[4-[4-(thiophene-2-carbonyl)piperazin-1-yl]phenyl]prop-2-enamide CAS Name: (E)-3-(5-bromo-2-methoxyphenyl)-N-[4-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]phenyl]-2-propenamide IUPAC Name: (E)-3-(5-bromo-2-methoxyphenyl)-N-[4-[4-(thiophene-2-carbonyl)piperazin-1-yl]phenyl]prop-2-enamide Traditional Name: (E)-3-(5-bromo-2-methoxy-phenyl)-N-[4-[4-(2-thenoyl)piperazino]phenyl]acrylamide Formula: C25H24BrN3O3S MolecularWeight: 526.44536

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C=CC(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CS4

Isomeric SMILES

COC1=C(C=C(C=C1)Br)/C=C/C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C25H24BrN3O3S/c1-32-22-10-5-19(26)17-18(22)4-11-24(30)27-20-6-8-21(9-7-20)28-12-14-29(15-13-28)25(31)23-3-2-16-33-23/h2-11,16-17H,12-15H2,1H3,(H,27,30)/b11-4+