2-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-3-[(1R)-1-phenylethyl]quinazolin-4-one

Systemtic Name: 2-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-3-[(1R)-1-phenylethyl]quinazolin-4-one Openeye Name: 2-[2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]sulfanyl-3-[(1R)-1-phenylethyl]quinazolin-4-one CAS Name: 2-[[2-[(2S)-2-methyl-1-piperidinyl]-2-oxoethyl]thio]-3-[(1R)-1-phenylethyl]-4-quinazolinone IUPAC Name: 2-[2-[(2S)-2-methylpiperidin-1-yl]-2-oxoethyl]sulfanyl-3-[(1R)-1-phenylethyl]quinazolin-4-one Traditional Name: 2-[[2-keto-2-[(2S)-2-methylpiperidino]ethyl]thio]-3-[(1R)-1-phenylethyl]quinazolin-4-one Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C(C)C4=CC=CC=C4

Isomeric SMILES

C[C@H]1CCCCN1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2[C@H](C)C4=CC=CC=C4

InChI

InChI=1S/C24H27N3O2S/c1-17-10-8-9-15-26(17)22(28)16-30-24-25-21-14-7-6-13-20(21)23(29)27(24)18(2)19-11-4-3-5-12-19/h3-7,11-14,17-18H,8-10,15-16H2,1-2H3/t17-,18+/m0/s1