2-[5-(1,3-benzodioxol-5-ylmethylidene)-4-oxidanylidene-3-(phenylmethyl)-1,3-thiazolidin-2-ylidene]propanedinitrile

Systemtic Name: 2-[5-(1,3-benzodioxol-5-ylmethylidene)-4-oxidanylidene-3-(phenylmethyl)-1,3-thiazolidin-2-ylidene]propanedinitrile Openeye Name: 2-[5-(1,3-benzodioxol-5-ylmethylene)-3-benzyl-4-oxo-thiazolidin-2-ylidene]propanedinitrile CAS Name: 2-[5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-3-(phenylmethyl)-2-thiazolidinylidene]propanedinitrile IUPAC Name: 2-[5-(1,3-benzodioxol-5-ylmethylidene)-3-benzyl-4-oxo-1,3-thiazolidin-2-ylidene]propanedinitrile Traditional Name: 2-(3-benzyl-4-keto-5-piperonylidene-thiazolidin-2-ylidene)malononitrile Formula: C21H13N3O3S MolecularWeight: 387.41122

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C3C(=O)N(C(=C(C#N)C#N)S3)CC4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C=C3C(=O)N(C(=C(C#N)C#N)S3)CC4=CC=CC=C4

InChI

InChI=1S/C21H13N3O3S/c22-10-16(11-23)21-24(12-14-4-2-1-3-5-14)20(25)19(28-21)9-15-6-7-17-18(8-15)27-13-26-17/h1-9H,12-13H2