2-(1,3-benzothiazol-2-ylmethylsulfanyl)-3-[3-(dimethylamino)propyl]quinazolin-4-one

Systemtic Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-3-[3-(dimethylamino)propyl]quinazolin-4-one Openeye Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-3-[3-(dimethylamino)propyl]quinazolin-4-one CAS Name: 2-(1,3-benzothiazol-2-ylmethylthio)-3-[3-(dimethylamino)propyl]-4-quinazolinone IUPAC Name: 2-(1,3-benzothiazol-2-ylmethylsulfanyl)-3-[3-(dimethylamino)propyl]quinazolin-4-one Traditional Name: 2-(1,3-benzothiazol-2-ylmethylthio)-3-[3-(dimethylamino)propyl]quinazolin-4-one Formula: C21H22N4OS2 MolecularWeight: 410.55558

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1C(=O)C2=CC=CC=C2N=C1SCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CN(C)CCCN1C(=O)C2=CC=CC=C2N=C1SCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H22N4OS2/c1-24(2)12-7-13-25-20(26)15-8-3-4-9-16(15)23-21(25)27-14-19-22-17-10-5-6-11-18(17)28-19/h3-6,8-11H,7,12-14H2,1-2H3