4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-phenethyl-3-[(E)-pyridin-2-ylmethylideneamino]-1,3-thiazol-2-imine

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-phenethyl-3-[(E)-pyridin-2-ylmethylideneamino]-1,3-thiazol-2-imine Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-phenethyl-3-[(E)-2-pyridylmethyleneamino]thiazol-2-imine CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-phenethyl-3-[(E)-2-pyridinylmethylideneamino]-2-thiazolimine IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-phenethyl-3-[(E)-pyridin-2-ylmethylideneamino]-1,3-thiazol-2-imine Traditional Name: (E)-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-phenethylimino-4-thiazolin-3-yl]-(2-pyridylmethylene)amine Formula: C25H22N4O2S MolecularWeight: 442.53278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C3=CSC(=NCCC4=CC=CC=C4)N3N=CC5=CC=CC=N5

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C3=CSC(=NCCC4=CC=CC=C4)N3/N=C/C5=CC=CC=N5

InChI

InChI=1S/C25H22N4O2S/c1-2-6-19(7-3-1)11-13-27-25-29(28-17-21-8-4-5-12-26-21)22(18-32-25)20-9-10-23-24(16-20)31-15-14-30-23/h1-10,12,16-18H,11,13-15H2/b27-25?,28-17+