6-(1H-indol-3-yl)-2-[3-(thiomorpholin-4-ylmethyl)phenyl]-1H-pyrimidin-4-one

Systemtic Name: 6-(1H-indol-3-yl)-2-[3-(thiomorpholin-4-ylmethyl)phenyl]-1H-pyrimidin-4-one Openeye Name: 6-(1H-indol-3-yl)-2-[3-(thiomorpholinomethyl)phenyl]-1H-pyrimidin-4-one CAS Name: 6-(1H-indol-3-yl)-2-[3-(thiomorpholin-4-ylmethyl)phenyl]-1H-pyrimidin-4-one IUPAC Name: 6-(1H-indol-3-yl)-2-[3-(thiomorpholin-4-ylmethyl)phenyl]-1H-pyrimidin-4-one Traditional Name: 6-(1H-indol-3-yl)-2-[3-(thiomorpholinomethyl)phenyl]-1H-pyrimidin-4-one Formula: C23H22N4OS MolecularWeight: 402.51198

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1CC2=CC=CC(=C2)C3=NC(=O)C=C(N3)C4=CNC5=CC=CC=C54

Isomeric SMILES

C1CSCCN1CC2=CC=CC(=C2)C3=NC(=O)C=C(N3)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C23H22N4OS/c28-22-13-21(19-14-24-20-7-2-1-6-18(19)20)25-23(26-22)17-5-3-4-16(12-17)15-27-8-10-29-11-9-27/h1-7,12-14,24H,8-11,15H2,(H,25,26,28)