N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-thiophen-2-yl]-3-oxidanylidene-benzo[f]chromene-2-carboxamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-thiophen-2-yl]-3-oxidanylidene-benzo[f]chromene-2-carboxamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-2-thienyl]-3-oxo-benzo[f]chromene-2-carboxamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methyl-2-thiophenyl]-3-oxo-2-benzo[f][1]benzopyrancarboxamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-3-cyano-4-methylthiophen-2-yl]-3-oxobenzo[f]chromene-2-carboxamide Traditional Name: N-(3-cyano-4-methyl-5-piperonyl-2-thienyl)-3-keto-benzo[f]chromene-2-carboxamide Formula: C28H18N2O5S MolecularWeight: 494.51792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2=CC3=C(C=CC4=CC=CC=C43)OC2=O)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2=CC3=C(C=CC4=CC=CC=C43)OC2=O)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C28H18N2O5S/c1-15-21(13-29)27(36-25(15)11-16-6-8-23-24(10-16)34-14-33-23)30-26(31)20-12-19-18-5-3-2-4-17(18)7-9-22(19)35-28(20)32/h2-10,12H,11,14H2,1H3,(H,30,31)