3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-(2-bromophenyl)-N-(2-methoxyethyl)-1,3-thiazol-2-imine

Systemtic Name: 3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-(2-bromophenyl)-N-(2-methoxyethyl)-1,3-thiazol-2-imine Openeye Name: 3-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-4-(2-bromophenyl)-N-(2-methoxyethyl)thiazol-2-imine CAS Name: 3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-(2-bromophenyl)-N-(2-methoxyethyl)-2-thiazolimine IUPAC Name: 3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-4-(2-bromophenyl)-N-(2-methoxyethyl)-1,3-thiazol-2-imine Traditional Name: (E)-[4-(2-bromophenyl)-2-(2-methoxyethylimino)-4-thiazolin-3-yl]-piperonylidene-amine Formula: C20H18BrN3O3S MolecularWeight: 460.34422

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Descriptors Computed from Structure

Canonical SMILES:

COCCN=C1N(C(=CS1)C2=CC=CC=C2Br)N=CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COCCN=C1N(C(=CS1)C2=CC=CC=C2Br)/N=C/C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H18BrN3O3S/c1-25-9-8-22-20-24(17(12-28-20)15-4-2-3-5-16(15)21)23-11-14-6-7-18-19(10-14)27-13-26-18/h2-7,10-12H,8-9,13H2,1H3/b22-20?,23-11+