7-chloranyl-2-[2-[(2R)-2-methylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-3-(phenylmethyl)quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[2-[(2R)-2-methylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-3-(phenylmethyl)quinazolin-4-one Openeye Name: 3-benzyl-7-chloro-2-[2-[(2R)-2-methyl-1-piperidyl]-2-oxo-ethyl]sulfanyl-quinazolin-4-one CAS Name: 7-chloro-2-[[2-[(2R)-2-methyl-1-piperidinyl]-2-oxoethyl]thio]-3-(phenylmethyl)-4-quinazolinone IUPAC Name: 3-benzyl-7-chloro-2-[2-[(2R)-2-methylpiperidin-1-yl]-2-oxoethyl]sulfanylquinazolin-4-one Traditional Name: 3-benzyl-7-chloro-2-[[2-keto-2-[(2R)-2-methylpiperidino]ethyl]thio]quinazolin-4-one Formula: C23H24ClN3O2S MolecularWeight: 441.97356

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CC4=CC=CC=C4

Isomeric SMILES

C[C@@H]1CCCCN1C(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CC4=CC=CC=C4

InChI

InChI=1S/C23H24ClN3O2S/c1-16-7-5-6-12-26(16)21(28)15-30-23-25-20-13-18(24)10-11-19(20)22(29)27(23)14-17-8-3-2-4-9-17/h2-4,8-11,13,16H,5-7,12,14-15H2,1H3/t16-/m1/s1