(E)-1-[4-[2-methyl-5-(phenylmethyl)pyrimidin-4-yl]piperidin-1-yl]-3-thiophen-2-yl-prop-2-en-1-one

Systemtic Name: (E)-1-[4-[2-methyl-5-(phenylmethyl)pyrimidin-4-yl]piperidin-1-yl]-3-thiophen-2-yl-prop-2-en-1-one Openeye Name: (E)-1-[4-(5-benzyl-2-methyl-pyrimidin-4-yl)-1-piperidyl]-3-(2-thienyl)prop-2-en-1-one CAS Name: (E)-1-[4-[2-methyl-5-(phenylmethyl)-4-pyrimidinyl]-1-piperidinyl]-3-thiophen-2-yl-2-propen-1-one IUPAC Name: (E)-1-[4-(5-benzyl-2-methylpyrimidin-4-yl)piperidin-1-yl]-3-thiophen-2-ylprop-2-en-1-one Traditional Name: (E)-1-[4-(5-benzyl-2-methyl-pyrimidin-4-yl)piperidino]-3-(2-thienyl)prop-2-en-1-one Formula: C24H25N3OS MolecularWeight: 403.5398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=N1)C2CCN(CC2)C(=O)C=CC3=CC=CS3)CC4=CC=CC=C4

Isomeric SMILES

CC1=NC=C(C(=N1)C2CCN(CC2)C(=O)/C=C/C3=CC=CS3)CC4=CC=CC=C4

InChI

InChI=1S/C24H25N3OS/c1-18-25-17-21(16-19-6-3-2-4-7-19)24(26-18)20-11-13-27(14-12-20)23(28)10-9-22-8-5-15-29-22/h2-10,15,17,20H,11-14,16H2,1H3/b10-9+