4-(1,3-benzothiazol-2-ylsulfanyl)-5-morpholin-4-yl-benzene-1,2-dicarbonitrile

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-5-morpholin-4-yl-benzene-1,2-dicarbonitrile Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-5-morpholino-phthalonitrile CAS Name: 4-(1,3-benzothiazol-2-ylthio)-5-(4-morpholinyl)benzene-1,2-dicarbonitrile IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-5-morpholin-4-ylbenzene-1,2-dicarbonitrile Traditional Name: 4-(1,3-benzothiazol-2-ylthio)-5-morpholino-phthalonitrile Formula: C19H14N4OS2 MolecularWeight: 378.47066

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C(=C2)C#N)C#N)SC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1COCCN1C2=C(C=C(C(=C2)C#N)C#N)SC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H14N4OS2/c20-11-13-9-16(23-5-7-24-8-6-23)18(10-14(13)12-21)26-19-22-15-3-1-2-4-17(15)25-19/h1-4,9-10H,5-8H2