3-(1,3-benzodioxol-5-ylmethylideneamino)-4-(3-bromophenyl)-N-(2-methylprop-2-enyl)-1,3-thiazol-2-imine

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethylideneamino)-4-(3-bromophenyl)-N-(2-methylprop-2-enyl)-1,3-thiazol-2-imine Openeye Name: 3-(1,3-benzodioxol-5-ylmethyleneamino)-4-(3-bromophenyl)-N-(2-methylallyl)thiazol-2-imine CAS Name: 3-(1,3-benzodioxol-5-ylmethylideneamino)-4-(3-bromophenyl)-N-(2-methylprop-2-enyl)-2-thiazolimine IUPAC Name: 3-(1,3-benzodioxol-5-ylmethylideneamino)-4-(3-bromophenyl)-N-(2-methylprop-2-enyl)-1,3-thiazol-2-imine Traditional Name: [4-(3-bromophenyl)-2-(2-methylallylimino)-4-thiazolin-3-yl]-piperonylidene-amine Formula: C21H18BrN3O2S MolecularWeight: 456.35552

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CN=C1N(C(=CS1)C2=CC(=CC=C2)Br)N=CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC(=C)CN=C1N(C(=CS1)C2=CC(=CC=C2)Br)N=CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H18BrN3O2S/c1-14(2)10-23-21-25(18(12-28-21)16-4-3-5-17(22)9-16)24-11-15-6-7-19-20(8-15)27-13-26-19/h3-9,11-12H,1,10,13H2,2H3