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

Systemtic Name: 3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-N-butyl-4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-imine Openeye Name: 3-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-N-butyl-4-(2,5-dimethoxyphenyl)thiazol-2-imine CAS Name: 3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-N-butyl-4-(2,5-dimethoxyphenyl)-2-thiazolimine IUPAC Name: 3-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-N-butyl-4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-imine Traditional Name: butyl-[4-(2,5-dimethoxyphenyl)-3-[(E)-piperonylideneamino]-4-thiazolin-2-ylidene]amine Formula: C23H25N3O4S MolecularWeight: 439.5273

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN=C1N(C(=CS1)C2=C(C=CC(=C2)OC)OC)N=CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCCN=C1N(C(=CS1)C2=C(C=CC(=C2)OC)OC)/N=C/C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H25N3O4S/c1-4-5-10-24-23-26(25-13-16-6-8-21-22(11-16)30-15-29-21)19(14-31-23)18-12-17(27-2)7-9-20(18)28-3/h6-9,11-14H,4-5,10,15H2,1-3H3/b24-23?,25-13+