7-chloranyl-2-[2-(4-methylphenoxy)ethylsulfanyl]-3-[(2S)-2-oxidanylpropyl]quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[2-(4-methylphenoxy)ethylsulfanyl]-3-[(2S)-2-oxidanylpropyl]quinazolin-4-one Openeye Name: 7-chloro-3-[(2S)-2-hydroxypropyl]-2-[2-(4-methylphenoxy)ethylsulfanyl]quinazolin-4-one CAS Name: 7-chloro-3-[(2S)-2-hydroxypropyl]-2-[2-(4-methylphenoxy)ethylthio]-4-quinazolinone IUPAC Name: 7-chloro-3-[(2S)-2-hydroxypropyl]-2-[2-(4-methylphenoxy)ethylsulfanyl]quinazolin-4-one Traditional Name: 7-chloro-3-[(2S)-2-hydroxypropyl]-2-[2-(4-methylphenoxy)ethylthio]quinazolin-4-one Formula: C20H21ClN2O3S MolecularWeight: 404.91034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CC(C)O

Isomeric SMILES

CC1=CC=C(C=C1)OCCSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C[C@H](C)O

InChI

InChI=1S/C20H21ClN2O3S/c1-13-3-6-16(7-4-13)26-9-10-27-20-22-18-11-15(21)5-8-17(18)19(25)23(20)12-14(2)24/h3-8,11,14,24H,9-10,12H2,1-2H3/t14-/m0/s1