N-(3-cyano-4-methyl-thiophen-2-yl)-2-[4-[4-(3-methylphenoxy)pyrimidin-2-yl]piperazin-1-yl]ethanamide

Systemtic Name: N-(3-cyano-4-methyl-thiophen-2-yl)-2-[4-[4-(3-methylphenoxy)pyrimidin-2-yl]piperazin-1-yl]ethanamide Openeye Name: N-(3-cyano-4-methyl-2-thienyl)-2-[4-[4-(3-methylphenoxy)pyrimidin-2-yl]piperazin-1-yl]acetamide CAS Name: N-(3-cyano-4-methyl-2-thiophenyl)-2-[4-[4-(3-methylphenoxy)-2-pyrimidinyl]-1-piperazinyl]acetamide IUPAC Name: N-(3-cyano-4-methylthiophen-2-yl)-2-[4-[4-(3-methylphenoxy)pyrimidin-2-yl]piperazin-1-yl]acetamide Traditional Name: N-(3-cyano-4-methyl-2-thienyl)-2-[4-[4-(3-methylphenoxy)pyrimidin-2-yl]piperazino]acetamide Formula: C23H24N6O2S MolecularWeight: 448.54066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=NC(=NC=C2)N3CCN(CC3)CC(=O)NC4=C(C(=CS4)C)C#N

Isomeric SMILES

CC1=CC(=CC=C1)OC2=NC(=NC=C2)N3CCN(CC3)CC(=O)NC4=C(C(=CS4)C)C#N

InChI

InChI=1S/C23H24N6O2S/c1-16-4-3-5-18(12-16)31-21-6-7-25-23(27-21)29-10-8-28(9-11-29)14-20(30)26-22-19(13-24)17(2)15-32-22/h3-7,12,15H,8-11,14H2,1-2H3,(H,26,30)