2-[[(5R)-3,5-diethyl-5-methyl-4-oxidanylidene-6H-benzo[h]quinazolin-2-yl]sulfanyl]-N-phenyl-ethanamide

Systemtic Name: 2-[[(5R)-3,5-diethyl-5-methyl-4-oxidanylidene-6H-benzo[h]quinazolin-2-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: 2-[[(5R)-3,5-diethyl-5-methyl-4-oxo-6H-benzo[h]quinazolin-2-yl]sulfanyl]-N-phenyl-acetamide CAS Name: 2-[[(5R)-3,5-diethyl-5-methyl-4-oxo-6H-benzo[h]quinazolin-2-yl]thio]-N-phenylacetamide IUPAC Name: 2-[[(5R)-3,5-diethyl-5-methyl-4-oxo-6H-benzo[h]quinazolin-2-yl]sulfanyl]-N-phenylacetamide Traditional Name: 2-[[(5R)-3,5-diethyl-4-keto-5-methyl-6H-benzo[h]quinazolin-2-yl]thio]-N-phenyl-acetamide Formula: C25H27N3O2S MolecularWeight: 433.56578

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC2=CC=CC=C2C3=C1C(=O)N(C(=N3)SCC(=O)NC4=CC=CC=C4)CC)C

Isomeric SMILES

CC[C@@]1(CC2=CC=CC=C2C3=C1C(=O)N(C(=N3)SCC(=O)NC4=CC=CC=C4)CC)C

InChI

InChI=1S/C25H27N3O2S/c1-4-25(3)15-17-11-9-10-14-19(17)22-21(25)23(30)28(5-2)24(27-22)31-16-20(29)26-18-12-7-6-8-13-18/h6-14H,4-5,15-16H2,1-3H3,(H,26,29)/t25-/m1/s1