2,3-dihydro-1-benzofuran-2-yl-[3-[5-methyl-2-(2-morpholin-4-ylethylsulfanyl)pyrimidin-4-yl]piperidin-1-yl]methanone

Systemtic Name: 2,3-dihydro-1-benzofuran-2-yl-[3-[5-methyl-2-(2-morpholin-4-ylethylsulfanyl)pyrimidin-4-yl]piperidin-1-yl]methanone Openeye Name: 2,3-dihydrobenzofuran-2-yl-[3-[5-methyl-2-(2-morpholinoethylsulfanyl)pyrimidin-4-yl]-1-piperidyl]methanone CAS Name: 2,3-dihydrobenzofuran-2-yl-[3-[5-methyl-2-[2-(4-morpholinyl)ethylthio]-4-pyrimidinyl]-1-piperidinyl]methanone IUPAC Name: 2,3-dihydro-1-benzofuran-2-yl-[3-[5-methyl-2-(2-morpholin-4-ylethylsulfanyl)pyrimidin-4-yl]piperidin-1-yl]methanone Traditional Name: coumaran-2-yl-[3-[5-methyl-2-(2-morpholinoethylthio)pyrimidin-4-yl]piperidino]methanone Formula: C25H32N4O3S MolecularWeight: 468.61158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1C2CCCN(C2)C(=O)C3CC4=CC=CC=C4O3)SCCN5CCOCC5

Isomeric SMILES

CC1=CN=C(N=C1C2CCCN(C2)C(=O)C3CC4=CC=CC=C4O3)SCCN5CCOCC5

InChI

InChI=1S/C25H32N4O3S/c1-18-16-26-25(33-14-11-28-9-12-31-13-10-28)27-23(18)20-6-4-8-29(17-20)24(30)22-15-19-5-2-3-7-21(19)32-22/h2-3,5,7,16,20,22H,4,6,8-15,17H2,1H3