[1-[[2-(2-methylphenyl)pyrimidin-5-yl]methyl]piperidin-3-yl]-(3-methylthiophen-2-yl)methanone

Systemtic Name: [1-[[2-(2-methylphenyl)pyrimidin-5-yl]methyl]piperidin-3-yl]-(3-methylthiophen-2-yl)methanone Openeye Name: (3-methyl-2-thienyl)-[1-[[2-(o-tolyl)pyrimidin-5-yl]methyl]-3-piperidyl]methanone CAS Name: [1-[[2-(2-methylphenyl)-5-pyrimidinyl]methyl]-3-piperidinyl]-(3-methyl-2-thiophenyl)methanone IUPAC Name: [1-[[2-(2-methylphenyl)pyrimidin-5-yl]methyl]piperidin-3-yl]-(3-methylthiophen-2-yl)methanone Traditional Name: (3-methyl-2-thienyl)-[1-[[2-(o-tolyl)pyrimidin-5-yl]methyl]-3-piperidyl]methanone Formula: C23H25N3OS MolecularWeight: 391.5291

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C(=O)C2CCCN(C2)CC3=CN=C(N=C3)C4=CC=CC=C4C

Isomeric SMILES

CC1=C(SC=C1)C(=O)C2CCCN(C2)CC3=CN=C(N=C3)C4=CC=CC=C4C

InChI

InChI=1S/C23H25N3OS/c1-16-6-3-4-8-20(16)23-24-12-18(13-25-23)14-26-10-5-7-19(15-26)21(27)22-17(2)9-11-28-22/h3-4,6,8-9,11-13,19H,5,7,10,14-15H2,1-2H3