3-(1,3-benzodioxol-5-ylmethyl)-4-(3-bromophenyl)-N-pyridin-3-yl-1,3-thiazol-2-imine

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-4-(3-bromophenyl)-N-pyridin-3-yl-1,3-thiazol-2-imine Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-4-(3-bromophenyl)-N-(3-pyridyl)thiazol-2-imine CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-4-(3-bromophenyl)-N-(3-pyridinyl)-2-thiazolimine IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-4-(3-bromophenyl)-N-pyridin-3-yl-1,3-thiazol-2-imine Traditional Name: [4-(3-bromophenyl)-3-piperonyl-4-thiazolin-2-ylidene]-(3-pyridyl)amine Formula: C22H16BrN3O2S MolecularWeight: 466.35034

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN3C(=CSC3=NC4=CN=CC=C4)C5=CC(=CC=C5)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN3C(=CSC3=NC4=CN=CC=C4)C5=CC(=CC=C5)Br

InChI

InChI=1S/C22H16BrN3O2S/c23-17-4-1-3-16(10-17)19-13-29-22(25-18-5-2-8-24-11-18)26(19)12-15-6-7-20-21(9-15)28-14-27-20/h1-11,13H,12,14H2