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

Systemtic Name: 3,5-diethyl-5-methyl-2-(phenylmethylsulfanyl)-6H-benzo[h]quinazolin-4-one Openeye Name: 2-benzylsulfanyl-3,5-diethyl-5-methyl-6H-benzo[h]quinazolin-4-one CAS Name: 3,5-diethyl-5-methyl-2-(phenylmethylthio)-6H-benzo[h]quinazolin-4-one IUPAC Name: 2-benzylsulfanyl-3,5-diethyl-5-methyl-6H-benzo[h]quinazolin-4-one Traditional Name: 2-(benzylthio)-3,5-diethyl-5-methyl-6H-benzo[h]quinazolin-4-one Formula: C24H26N2OS MolecularWeight: 390.54104

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC2=CC=CC=C2C3=C1C(=O)N(C(=N3)SCC4=CC=CC=C4)CC)C

Isomeric SMILES

CCC1(CC2=CC=CC=C2C3=C1C(=O)N(C(=N3)SCC4=CC=CC=C4)CC)C

InChI

InChI=1S/C24H26N2OS/c1-4-24(3)15-18-13-9-10-14-19(18)21-20(24)22(27)26(5-2)23(25-21)28-16-17-11-7-6-8-12-17/h6-14H,4-5,15-16H2,1-3H3