3-ethylsulfanyl-5-methyl-2-(3-methyl-2-oxidanylidene-4,6-diphenyl-1H-pyrimidin-4-yl)-2,4-diphenyl-1,5-diazabicyclo[2.2.0]hexan-6-one

Systemtic Name: 3-ethylsulfanyl-5-methyl-2-(3-methyl-2-oxidanylidene-4,6-diphenyl-1H-pyrimidin-4-yl)-2,4-diphenyl-1,5-diazabicyclo[2.2.0]hexan-6-one Openeye Name: 3-ethylsulfanyl-5-methyl-2-(3-methyl-2-oxo-4,6-diphenyl-1H-pyrimidin-4-yl)-2,4-diphenyl-1,5-diazabicyclo[2.2.0]hexan-6-one CAS Name: 3-(ethylthio)-5-methyl-2-(3-methyl-2-oxo-4,6-diphenyl-1H-pyrimidin-4-yl)-2,4-diphenyl-1,5-diazabicyclo[2.2.0]hexan-6-one IUPAC Name: 3-ethylsulfanyl-5-methyl-2-(3-methyl-2-oxo-4,6-diphenyl-1H-pyrimidin-4-yl)-2,4-diphenyl-1,5-diazabicyclo[2.2.0]hexan-6-one Traditional Name: 3-(ethylthio)-2-(2-keto-3-methyl-4,6-diphenyl-1H-pyrimidin-4-yl)-5-methyl-2,4-diphenyl-1,5-diazabicyclo[2.2.0]hexan-6-one Formula: C36H34N4O2S MolecularWeight: 586.74576

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1C(N2C1(N(C2=O)C)C3=CC=CC=C3)(C4=CC=CC=C4)C5(C=C(NC(=O)N5C)C6=CC=CC=C6)C7=CC=CC=C7

Isomeric SMILES

CCSC1C(N2C1(N(C2=O)C)C3=CC=CC=C3)(C4=CC=CC=C4)C5(C=C(NC(=O)N5C)C6=CC=CC=C6)C7=CC=CC=C7

InChI

InChI=1S/C36H34N4O2S/c1-4-43-31-35(28-21-13-7-14-22-28,40-33(42)39(3)36(31,40)29-23-15-8-16-24-29)34(27-19-11-6-12-20-27)25-30(37-32(41)38(34)2)26-17-9-5-10-18-26/h5-25,31H,4H2,1-3H3,(H,37,41)