(E)-3-(5-bromanylthiophen-2-yl)-N-[3-methyl-4-(4-methylpiperazin-1-yl)phenyl]prop-2-enamide

Systemtic Name: (E)-3-(5-bromanylthiophen-2-yl)-N-[3-methyl-4-(4-methylpiperazin-1-yl)phenyl]prop-2-enamide Openeye Name: (E)-3-(5-bromo-2-thienyl)-N-[3-methyl-4-(4-methylpiperazin-1-yl)phenyl]prop-2-enamide CAS Name: (E)-3-(5-bromo-2-thiophenyl)-N-[3-methyl-4-(4-methyl-1-piperazinyl)phenyl]-2-propenamide IUPAC Name: (E)-3-(5-bromothiophen-2-yl)-N-[3-methyl-4-(4-methylpiperazin-1-yl)phenyl]prop-2-enamide Traditional Name: (E)-3-(5-bromo-2-thienyl)-N-[3-methyl-4-(4-methylpiperazino)phenyl]acrylamide Formula: C19H22BrN3OS MolecularWeight: 420.36648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C=CC2=CC=C(S2)Br)N3CCN(CC3)C

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)/C=C/C2=CC=C(S2)Br)N3CCN(CC3)C

InChI

InChI=1S/C19H22BrN3OS/c1-14-13-15(3-6-17(14)23-11-9-22(2)10-12-23)21-19(24)8-5-16-4-7-18(20)25-16/h3-8,13H,9-12H2,1-2H3,(H,21,24)/b8-5+