2-(1,3-benzothiazol-2-ylmethylsulfanyl)-7-chloranyl-3-prop-2-enyl-quinazolin-4-one

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-7-chloranyl-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-2-(1,3-benzothiazol-2-ylmethylsulfanyl)-7-chloro-quinazolin-4-one CAS Name: 2-(1,3-benzothiazol-2-ylmethylthio)-7-chloro-3-prop-2-enyl-4-quinazolinone IUPAC Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-7-chloro-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-2-(1,3-benzothiazol-2-ylmethylthio)-7-chloro-quinazolin-4-one Formula: C19H14ClN3OS2 MolecularWeight: 399.91696

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C=CCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H14ClN3OS2/c1-2-9-23-18(24)13-8-7-12(20)10-15(13)22-19(23)25-11-17-21-14-5-3-4-6-16(14)26-17/h2-8,10H,1,9,11H2