5-azanyl-N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3,4-diphenyl-thieno[2,3-c]pyridazine-6-carboxamide

Systemtic Name: 5-azanyl-N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3,4-diphenyl-thieno[2,3-c]pyridazine-6-carboxamide Openeye Name: 5-amino-N-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-3,4-diphenyl-thieno[2,3-c]pyridazine-6-carboxamide CAS Name: 5-amino-N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3,4-diphenyl-6-thieno[2,3-c]pyridazinecarboxamide IUPAC Name: 5-amino-N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-3,4-diphenylthieno[2,3-c]pyridazine-6-carboxamide Traditional Name: 5-amino-3,4-diphenyl-N-[(E)-piperonylideneamino]thieno[2,3-c]pyridazine-6-carboxamide Formula: C27H19N5O3S MolecularWeight: 493.53646

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=NNC(=O)C3=C(C4=C(C(=NN=C4S3)C5=CC=CC=C5)C6=CC=CC=C6)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=N/NC(=O)C3=C(C4=C(C(=NN=C4S3)C5=CC=CC=C5)C6=CC=CC=C6)N

InChI

InChI=1S/C27H19N5O3S/c28-23-22-21(17-7-3-1-4-8-17)24(18-9-5-2-6-10-18)30-32-27(22)36-25(23)26(33)31-29-14-16-11-12-19-20(13-16)35-15-34-19/h1-14H,15,28H2,(H,31,33)/b29-14+