1-(phenylmethoxymethyl)-6-phenylsulfanyl-5-propan-2-yl-2-sulfanylidene-pyrimidin-4-one

Systemtic Name: 1-(phenylmethoxymethyl)-6-phenylsulfanyl-5-propan-2-yl-2-sulfanylidene-pyrimidin-4-one Openeye Name: 1-(benzyloxymethyl)-5-isopropyl-6-phenylsulfanyl-2-thioxo-pyrimidin-4-one CAS Name: 1-(phenylmethoxymethyl)-6-(phenylthio)-5-propan-2-yl-2-sulfanylidene-4-pyrimidinone IUPAC Name: 1-(phenylmethoxymethyl)-6-phenylsulfanyl-5-propan-2-yl-2-sulfanylidenepyrimidin-4-one Traditional Name: 1-(benzoxymethyl)-5-isopropyl-6-(phenylthio)-2-thioxo-pyrimidin-4-one Formula: C21H22N2O2S2 MolecularWeight: 398.54158

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N(C(=S)NC1=O)COCC2=CC=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=C(N(C(=S)NC1=O)COCC2=CC=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C21H22N2O2S2/c1-15(2)18-19(24)22-21(26)23(14-25-13-16-9-5-3-6-10-16)20(18)27-17-11-7-4-8-12-17/h3-12,15H,13-14H2,1-2H3,(H,22,24,26)