(5R)-2-[(2R)-1-(diphenylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-5-ethyl-5-methyl-6H-benzo[h]quinazolin-4-olate

Systemtic Name: (5R)-2-[(2R)-1-(diphenylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-5-ethyl-5-methyl-6H-benzo[h]quinazolin-4-olate Openeye Name: (5R)-5-ethyl-5-methyl-2-[(1R)-1-methyl-2-oxo-2-(N-phenylanilino)ethyl]sulfanyl-6H-benzo[h]quinazolin-4-olate CAS Name: (5R)-5-ethyl-5-methyl-2-[[(2R)-1-oxo-1-(N-phenylanilino)propan-2-yl]thio]-6H-benzo[h]quinazolin-4-olate IUPAC Name: (5R)-5-ethyl-5-methyl-2-[(2R)-1-oxo-1-(N-phenylanilino)propan-2-yl]sulfanyl-6H-benzo[h]quinazolin-4-olate Traditional Name: (5R)-5-ethyl-2-[[(1R)-2-keto-1-methyl-2-(N-phenylanilino)ethyl]thio]-5-methyl-6H-benzo[h]quinazolin-4-olate Formula: C30H28N3O2S- MolecularWeight: 494.62722

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC2=CC=CC=C2C3=C1C(=NC(=N3)SC(C)C(=O)N(C4=CC=CC=C4)C5=CC=CC=C5)[O-])C

Isomeric SMILES

CC[C@@]1(CC2=CC=CC=C2C3=C1C(=NC(=N3)S[C@H](C)C(=O)N(C4=CC=CC=C4)C5=CC=CC=C5)[O-])C

InChI

InChI=1S/C30H29N3O2S/c1-4-30(3)19-21-13-11-12-18-24(21)26-25(30)27(34)32-29(31-26)36-20(2)28(35)33(22-14-7-5-8-15-22)23-16-9-6-10-17-23/h5-18,20H,4,19H2,1-3H3,(H,31,32,34)/p-1/t20-,30-/m1/s1