4-[4-(1,3-benzoxazol-2-ylsulfanyl)phthalazin-1-yl]-N,N-dimethyl-benzamide

Systemtic Name: 4-[4-(1,3-benzoxazol-2-ylsulfanyl)phthalazin-1-yl]-N,N-dimethyl-benzamide Openeye Name: 4-[4-(1,3-benzoxazol-2-ylsulfanyl)phthalazin-1-yl]-N,N-dimethyl-benzamide CAS Name: 4-[4-(1,3-benzoxazol-2-ylthio)-1-phthalazinyl]-N,N-dimethylbenzamide IUPAC Name: 4-[4-(1,3-benzoxazol-2-ylsulfanyl)phthalazin-1-yl]-N,N-dimethylbenzamide Traditional Name: 4-[4-(1,3-benzoxazol-2-ylthio)phthalazin-1-yl]-N,N-dimethyl-benzamide Formula: C24H18N4O2S MolecularWeight: 426.49032

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SC4=NC5=CC=CC=C5O4

Isomeric SMILES

CN(C)C(=O)C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SC4=NC5=CC=CC=C5O4

InChI

InChI=1S/C24H18N4O2S/c1-28(2)23(29)16-13-11-15(12-14-16)21-17-7-3-4-8-18(17)22(27-26-21)31-24-25-19-9-5-6-10-20(19)30-24/h3-14H,1-2H3