(4-methylpiperazin-1-yl)-[4-[(4-thiophen-2-ylpyrimidin-2-yl)amino]phenyl]methanone

Systemtic Name: (4-methylpiperazin-1-yl)-[4-[(4-thiophen-2-ylpyrimidin-2-yl)amino]phenyl]methanone Openeye Name: (4-methylpiperazin-1-yl)-[4-[[4-(2-thienyl)pyrimidin-2-yl]amino]phenyl]methanone CAS Name: (4-methyl-1-piperazinyl)-[4-[(4-thiophen-2-yl-2-pyrimidinyl)amino]phenyl]methanone IUPAC Name: (4-methylpiperazin-1-yl)-[4-[(4-thiophen-2-ylpyrimidin-2-yl)amino]phenyl]methanone Traditional Name: (4-methylpiperazino)-[4-[[4-(2-thienyl)pyrimidin-2-yl]amino]phenyl]methanone Formula: C20H21N5OS MolecularWeight: 379.47864

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CC=C(C=C2)NC3=NC=CC(=N3)C4=CC=CS4

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CC=C(C=C2)NC3=NC=CC(=N3)C4=CC=CS4

InChI

InChI=1S/C20H21N5OS/c1-24-10-12-25(13-11-24)19(26)15-4-6-16(7-5-15)22-20-21-9-8-17(23-20)18-3-2-14-27-18/h2-9,14H,10-13H2,1H3,(H,21,22,23)