2-[(2-ethyl-1,3-thiazol-4-yl)methylsulfanyl]-3-[(4-methoxyphenyl)methyl]quinazolin-4-one

Systemtic Name: 2-[(2-ethyl-1,3-thiazol-4-yl)methylsulfanyl]-3-[(4-methoxyphenyl)methyl]quinazolin-4-one Openeye Name: 2-[(2-ethylthiazol-4-yl)methylsulfanyl]-3-[(4-methoxyphenyl)methyl]quinazolin-4-one CAS Name: 2-[(2-ethyl-4-thiazolyl)methylthio]-3-[(4-methoxyphenyl)methyl]-4-quinazolinone IUPAC Name: 2-[(2-ethyl-1,3-thiazol-4-yl)methylsulfanyl]-3-[(4-methoxyphenyl)methyl]quinazolin-4-one Traditional Name: 2-[(2-ethylthiazol-4-yl)methylthio]-3-p-anisyl-quinazolin-4-one Formula: C22H21N3O2S2 MolecularWeight: 423.55104

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=CS1)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=C(C=C4)OC

Isomeric SMILES

CCC1=NC(=CS1)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=C(C=C4)OC

InChI

InChI=1S/C22H21N3O2S2/c1-3-20-23-16(13-28-20)14-29-22-24-19-7-5-4-6-18(19)21(26)25(22)12-15-8-10-17(27-2)11-9-15/h4-11,13H,3,12,14H2,1-2H3