2-[[(5R)-5-cyclohexyl-5-methyl-4-oxidanylidene-1,6-dihydrobenzo[h]quinazolin-2-yl]sulfanyl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[[(5R)-5-cyclohexyl-5-methyl-4-oxidanylidene-1,6-dihydrobenzo[h]quinazolin-2-yl]sulfanyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[[(5R)-5-cyclohexyl-5-methyl-4-oxo-1,6-dihydrobenzo[h]quinazolin-2-yl]sulfanyl]acetamide CAS Name: 2-[[(5R)-5-cyclohexyl-5-methyl-4-oxo-1,6-dihydrobenzo[h]quinazolin-2-yl]thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[[(5R)-5-cyclohexyl-5-methyl-4-oxo-1,6-dihydrobenzo[h]quinazolin-2-yl]sulfanyl]acetamide Traditional Name: N-benzyl-2-[[(5R)-5-cyclohexyl-4-keto-5-methyl-1,6-dihydrobenzo[h]quinazolin-2-yl]thio]acetamide Formula: C28H31N3O2S MolecularWeight: 473.62964

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=CC=CC=C2C3=C1C(=O)N=C(N3)SCC(=O)NCC4=CC=CC=C4)C5CCCCC5

Isomeric SMILES

C[C@@]1(CC2=CC=CC=C2C3=C1C(=O)N=C(N3)SCC(=O)NCC4=CC=CC=C4)C5CCCCC5

InChI

InChI=1S/C28H31N3O2S/c1-28(21-13-6-3-7-14-21)16-20-12-8-9-15-22(20)25-24(28)26(33)31-27(30-25)34-18-23(32)29-17-19-10-4-2-5-11-19/h2,4-5,8-12,15,21H,3,6-7,13-14,16-18H2,1H3,(H,29,32)(H,30,31,33)/t28-/m1/s1