2-(dimethylamino)-N-[3-[(E)-3-[5-(2-methylphenyl)-2-(4-methylpiperazin-1-yl)phenyl]prop-2-enoyl]phenyl]ethanamide

Systemtic Name: 2-(dimethylamino)-N-[3-[(E)-3-[5-(2-methylphenyl)-2-(4-methylpiperazin-1-yl)phenyl]prop-2-enoyl]phenyl]ethanamide Openeye Name: 2-(dimethylamino)-N-[3-[(E)-3-[2-(4-methylpiperazin-1-yl)-5-(o-tolyl)phenyl]prop-2-enoyl]phenyl]acetamide CAS Name: 2-(dimethylamino)-N-[3-[(E)-3-[5-(2-methylphenyl)-2-(4-methyl-1-piperazinyl)phenyl]-1-oxoprop-2-enyl]phenyl]acetamide IUPAC Name: 2-(dimethylamino)-N-[3-[(E)-3-[5-(2-methylphenyl)-2-(4-methylpiperazin-1-yl)phenyl]prop-2-enoyl]phenyl]acetamide Traditional Name: 2-(dimethylamino)-N-[3-[(E)-3-[2-(4-methylpiperazino)-5-(o-tolyl)phenyl]acryloyl]phenyl]acetamide Formula: C31H36N4O2 MolecularWeight: 496.64314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC(=C(C=C2)N3CCN(CC3)C)C=CC(=O)C4=CC(=CC=C4)NC(=O)CN(C)C

Isomeric SMILES

CC1=CC=CC=C1C2=CC(=C(C=C2)N3CCN(CC3)C)/C=C/C(=O)C4=CC(=CC=C4)NC(=O)CN(C)C

InChI

InChI=1S/C31H36N4O2/c1-23-8-5-6-11-28(23)24-12-14-29(35-18-16-34(4)17-19-35)25(20-24)13-15-30(36)26-9-7-10-27(21-26)32-31(37)22-33(2)3/h5-15,20-21H,16-19,22H2,1-4H3,(H,32,37)/b15-13+