2-(1,3-benzothiazol-2-ylmethylsulfanyl)-3-[(4-methoxyphenyl)methyl]quinazolin-4-one

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-3-[(4-methoxyphenyl)methyl]quinazolin-4-one Openeye Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-3-[(4-methoxyphenyl)methyl]quinazolin-4-one CAS Name: 2-(1,3-benzothiazol-2-ylmethylthio)-3-[(4-methoxyphenyl)methyl]-4-quinazolinone IUPAC Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-3-[(4-methoxyphenyl)methyl]quinazolin-4-one Traditional Name: 2-(1,3-benzothiazol-2-ylmethylthio)-3-p-anisyl-quinazolin-4-one Formula: C24H19N3O2S2 MolecularWeight: 445.55656

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC4=NC5=CC=CC=C5S4

Isomeric SMILES

COC1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C24H19N3O2S2/c1-29-17-12-10-16(11-13-17)14-27-23(28)18-6-2-3-7-19(18)26-24(27)30-15-22-25-20-8-4-5-9-21(20)31-22/h2-13H,14-15H2,1H3