2-[(5-chloranyl-1-benzothiophen-3-yl)methylsulfanyl]-3-(phenylmethyl)quinazolin-4-one

Systemtic Name: 2-[(5-chloranyl-1-benzothiophen-3-yl)methylsulfanyl]-3-(phenylmethyl)quinazolin-4-one Openeye Name: 3-benzyl-2-[(5-chlorobenzothiophen-3-yl)methylsulfanyl]quinazolin-4-one CAS Name: 2-[(5-chloro-1-benzothiophen-3-yl)methylthio]-3-(phenylmethyl)-4-quinazolinone IUPAC Name: 3-benzyl-2-[(5-chloro-1-benzothiophen-3-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-benzyl-2-[(5-chlorobenzothiophen-3-yl)methylthio]quinazolin-4-one Formula: C24H17ClN2OS2 MolecularWeight: 448.98758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC4=CSC5=C4C=C(C=C5)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=CC=CC=C3N=C2SCC4=CSC5=C4C=C(C=C5)Cl

InChI

InChI=1S/C24H17ClN2OS2/c25-18-10-11-22-20(12-18)17(14-29-22)15-30-24-26-21-9-5-4-8-19(21)23(28)27(24)13-16-6-2-1-3-7-16/h1-12,14H,13,15H2