5-[2-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]-3,6-dimethyl-2-methylsulfanyl-pyrimidin-4-one

Systemtic Name: 5-[2-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]-3,6-dimethyl-2-methylsulfanyl-pyrimidin-4-one Openeye Name: 5-[2-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]-3,6-dimethyl-2-methylsulfanyl-pyrimidin-4-one CAS Name: 5-[2-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]-3,6-dimethyl-2-(methylthio)-4-pyrimidinone IUPAC Name: 5-[2-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]-3,6-dimethyl-2-methylsulfanylpyrimidin-4-one Traditional Name: 5-[2-[4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]-3,6-dimethyl-2-(methylthio)pyrimidin-4-one Formula: C22H26N4OS MolecularWeight: 394.53304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=N1)SC)C)CCN2CCC(=CC2)C3=CNC4=CC=CC=C43

Isomeric SMILES

CC1=C(C(=O)N(C(=N1)SC)C)CCN2CCC(=CC2)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C22H26N4OS/c1-15-17(21(27)25(2)22(24-15)28-3)10-13-26-11-8-16(9-12-26)19-14-23-20-7-5-4-6-18(19)20/h4-8,14,23H,9-13H2,1-3H3