2-[(4-phenylphthalazin-1-yl)sulfanylmethyl]-1,3-benzothiazole

Systemtic Name: 2-[(4-phenylphthalazin-1-yl)sulfanylmethyl]-1,3-benzothiazole Openeye Name: 2-[(4-phenylphthalazin-1-yl)sulfanylmethyl]-1,3-benzothiazole CAS Name: 2-[[(4-phenyl-1-phthalazinyl)thio]methyl]-1,3-benzothiazole IUPAC Name: 2-[(4-phenylphthalazin-1-yl)sulfanylmethyl]-1,3-benzothiazole Traditional Name: 2-[[(4-phenylphthalazin-1-yl)thio]methyl]-1,3-benzothiazole Formula: C22H15N3S2 MolecularWeight: 385.5046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SCC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SCC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C22H15N3S2/c1-2-8-15(9-3-1)21-16-10-4-5-11-17(16)22(25-24-21)26-14-20-23-18-12-6-7-13-19(18)27-20/h1-13H,14H2