[5-[[4-(2-methylpiperidin-1-yl)-6-phenyl-pyrimidin-2-yl]sulfanylmethyl]furan-2-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [5-[[4-(2-methylpiperidin-1-yl)-6-phenyl-pyrimidin-2-yl]sulfanylmethyl]furan-2-yl]-pyrrolidin-1-yl-methanone Openeye Name: [5-[[4-(2-methyl-1-piperidyl)-6-phenyl-pyrimidin-2-yl]sulfanylmethyl]-2-furyl]-pyrrolidin-1-yl-methanone CAS Name: [5-[[[4-(2-methyl-1-piperidinyl)-6-phenyl-2-pyrimidinyl]thio]methyl]-2-furanyl]-(1-pyrrolidinyl)methanone IUPAC Name: [5-[[4-(2-methylpiperidin-1-yl)-6-phenylpyrimidin-2-yl]sulfanylmethyl]furan-2-yl]-pyrrolidin-1-ylmethanone Traditional Name: [5-[[[4-(2-methylpiperidino)-6-phenyl-pyrimidin-2-yl]thio]methyl]-2-furyl]-pyrrolidino-methanone Formula: C26H30N4O2S MolecularWeight: 462.607

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C2=NC(=NC(=C2)C3=CC=CC=C3)SCC4=CC=C(O4)C(=O)N5CCCC5

Isomeric SMILES

CC1CCCCN1C2=NC(=NC(=C2)C3=CC=CC=C3)SCC4=CC=C(O4)C(=O)N5CCCC5

InChI

InChI=1S/C26H30N4O2S/c1-19-9-5-6-16-30(19)24-17-22(20-10-3-2-4-11-20)27-26(28-24)33-18-21-12-13-23(32-21)25(31)29-14-7-8-15-29/h2-4,10-13,17,19H,5-9,14-16,18H2,1H3