2-[2-(4-methylpiperazin-1-yl)ethylamino]-N-[3-[(5-thiophen-3-ylpyrimidin-2-yl)amino]phenyl]ethanamide

Systemtic Name: 2-[2-(4-methylpiperazin-1-yl)ethylamino]-N-[3-[(5-thiophen-3-ylpyrimidin-2-yl)amino]phenyl]ethanamide Openeye Name: 2-[2-(4-methylpiperazin-1-yl)ethylamino]-N-[3-[[5-(3-thienyl)pyrimidin-2-yl]amino]phenyl]acetamide CAS Name: 2-[2-(4-methyl-1-piperazinyl)ethylamino]-N-[3-[[5-(3-thiophenyl)-2-pyrimidinyl]amino]phenyl]acetamide IUPAC Name: 2-[2-(4-methylpiperazin-1-yl)ethylamino]-N-[3-[(5-thiophen-3-ylpyrimidin-2-yl)amino]phenyl]acetamide Traditional Name: 2-[2-(4-methylpiperazino)ethylamino]-N-[3-[[5-(3-thienyl)pyrimidin-2-yl]amino]phenyl]acetamide Formula: C23H29N7OS MolecularWeight: 451.58766

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCNCC(=O)NC2=CC=CC(=C2)NC3=NC=C(C=N3)C4=CSC=C4

Isomeric SMILES

CN1CCN(CC1)CCNCC(=O)NC2=CC=CC(=C2)NC3=NC=C(C=N3)C4=CSC=C4

InChI

InChI=1S/C23H29N7OS/c1-29-8-10-30(11-9-29)7-6-24-16-22(31)27-20-3-2-4-21(13-20)28-23-25-14-19(15-26-23)18-5-12-32-17-18/h2-5,12-15,17,24H,6-11,16H2,1H3,(H,27,31)(H,25,26,28)