3-(2,5-dimethylphenyl)-2-[(1S)-2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-(2,5-dimethylphenyl)-2-[(1S)-2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-(2,5-dimethylphenyl)-2-[(1S)-2-oxo-1-phenyl-2-(1-piperidyl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(2,5-dimethylphenyl)-2-[[(1S)-2-oxo-1-phenyl-2-(1-piperidinyl)ethyl]thio]-4-quinazolinone IUPAC Name: 3-(2,5-dimethylphenyl)-2-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]sulfanylquinazolin-4-one Traditional Name: 3-(2,5-dimethylphenyl)-2-[[(1S)-2-keto-1-phenyl-2-piperidino-ethyl]thio]quinazolin-4-one Formula: C29H29N3O2S MolecularWeight: 483.62446

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=O)C3=CC=CC=C3N=C2SC(C4=CC=CC=C4)C(=O)N5CCCCC5

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=O)C3=CC=CC=C3N=C2S[C@@H](C4=CC=CC=C4)C(=O)N5CCCCC5

InChI

InChI=1S/C29H29N3O2S/c1-20-15-16-21(2)25(19-20)32-27(33)23-13-7-8-14-24(23)30-29(32)35-26(22-11-5-3-6-12-22)28(34)31-17-9-4-10-18-31/h3,5-8,11-16,19,26H,4,9-10,17-18H2,1-2H3/t26-/m0/s1