N-[5-(4-tert-butylphenyl)-6-phenyl-pyridazin-3-yl]-1,3-benzothiazol-6-amine

Systemtic Name: N-[5-(4-tert-butylphenyl)-6-phenyl-pyridazin-3-yl]-1,3-benzothiazol-6-amine Openeye Name: N-[5-(4-tert-butylphenyl)-6-phenyl-pyridazin-3-yl]-1,3-benzothiazol-6-amine CAS Name: N-[5-(4-tert-butylphenyl)-6-phenyl-3-pyridazinyl]-1,3-benzothiazol-6-amine IUPAC Name: N-[5-(4-tert-butylphenyl)-6-phenylpyridazin-3-yl]-1,3-benzothiazol-6-amine Traditional Name: 1,3-benzothiazol-6-yl-[5-(4-tert-butylphenyl)-6-phenyl-pyridazin-3-yl]amine Formula: C27H24N4S MolecularWeight: 436.57126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CC(=NN=C2C3=CC=CC=C3)NC4=CC5=C(C=C4)N=CS5

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CC(=NN=C2C3=CC=CC=C3)NC4=CC5=C(C=C4)N=CS5

InChI

InChI=1S/C27H24N4S/c1-27(2,3)20-11-9-18(10-12-20)22-16-25(30-31-26(22)19-7-5-4-6-8-19)29-21-13-14-23-24(15-21)32-17-28-23/h4-17H,1-3H3,(H,29,30)