5,5-dimethyl-3-(phenylmethyl)-2-(phenylmethylsulfanyl)-6H-benzo[h]quinazolin-4-one

Systemtic Name: 5,5-dimethyl-3-(phenylmethyl)-2-(phenylmethylsulfanyl)-6H-benzo[h]quinazolin-4-one Openeye Name: 3-benzyl-2-benzylsulfanyl-5,5-dimethyl-6H-benzo[h]quinazolin-4-one CAS Name: 5,5-dimethyl-3-(phenylmethyl)-2-(phenylmethylthio)-6H-benzo[h]quinazolin-4-one IUPAC Name: 3-benzyl-2-benzylsulfanyl-5,5-dimethyl-6H-benzo[h]quinazolin-4-one Traditional Name: 3-benzyl-2-(benzylthio)-5,5-dimethyl-6H-benzo[h]quinazolin-4-one Formula: C28H26N2OS MolecularWeight: 438.58384

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C3=C1C(=O)N(C(=N3)SCC4=CC=CC=C4)CC5=CC=CC=C5)C

Isomeric SMILES

CC1(CC2=CC=CC=C2C3=C1C(=O)N(C(=N3)SCC4=CC=CC=C4)CC5=CC=CC=C5)C

InChI

InChI=1S/C28H26N2OS/c1-28(2)17-22-15-9-10-16-23(22)25-24(28)26(31)30(18-20-11-5-3-6-12-20)27(29-25)32-19-21-13-7-4-8-14-21/h3-16H,17-19H2,1-2H3