(5R)-5-ethyl-5-methyl-2-prop-2-enylsulfanyl-6H-benzo[h]quinazolin-4-olate

Systemtic Name: (5R)-5-ethyl-5-methyl-2-prop-2-enylsulfanyl-6H-benzo[h]quinazolin-4-olate Openeye Name: (5R)-2-allylsulfanyl-5-ethyl-5-methyl-6H-benzo[h]quinazolin-4-olate CAS Name: (5R)-5-ethyl-5-methyl-2-(prop-2-enylthio)-6H-benzo[h]quinazolin-4-olate IUPAC Name: (5R)-5-ethyl-5-methyl-2-prop-2-enylsulfanyl-6H-benzo[h]quinazolin-4-olate Traditional Name: (5R)-2-(allylthio)-5-ethyl-5-methyl-6H-benzo[h]quinazolin-4-olate Formula: C18H19N2OS- MolecularWeight: 311.42126

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC2=CC=CC=C2C3=C1C(=NC(=N3)SCC=C)[O-])C

Isomeric SMILES

CC[C@@]1(CC2=CC=CC=C2C3=C1C(=NC(=N3)SCC=C)[O-])C

InChI

InChI=1S/C18H20N2OS/c1-4-10-22-17-19-15-13-9-7-6-8-12(13)11-18(3,5-2)14(15)16(21)20-17/h4,6-9H,1,5,10-11H2,2-3H3,(H,19,20,21)/p-1/t18-/m1/s1