5-ethyl-5-methyl-2-(2-methylprop-2-enylsulfanyl)-3-phenyl-6H-benzo[h]quinazolin-4-one

Systemtic Name: 5-ethyl-5-methyl-2-(2-methylprop-2-enylsulfanyl)-3-phenyl-6H-benzo[h]quinazolin-4-one Openeye Name: 5-ethyl-5-methyl-2-(2-methylallylsulfanyl)-3-phenyl-6H-benzo[h]quinazolin-4-one CAS Name: 5-ethyl-5-methyl-2-(2-methylprop-2-enylthio)-3-phenyl-6H-benzo[h]quinazolin-4-one IUPAC Name: 5-ethyl-5-methyl-2-(2-methylprop-2-enylsulfanyl)-3-phenyl-6H-benzo[h]quinazolin-4-one Traditional Name: 5-ethyl-5-methyl-2-(2-methylallylthio)-3-phenyl-6H-benzo[h]quinazolin-4-one Formula: C25H26N2OS MolecularWeight: 402.55174

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC2=CC=CC=C2C3=C1C(=O)N(C(=N3)SCC(=C)C)C4=CC=CC=C4)C

Isomeric SMILES

CCC1(CC2=CC=CC=C2C3=C1C(=O)N(C(=N3)SCC(=C)C)C4=CC=CC=C4)C

InChI

InChI=1S/C25H26N2OS/c1-5-25(4)15-18-11-9-10-14-20(18)22-21(25)23(28)27(19-12-7-6-8-13-19)24(26-22)29-16-17(2)3/h6-14H,2,5,15-16H2,1,3-4H3