(E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-(thiophen-2-ylmethyl)prop-2-enamide

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-(thiophen-2-ylmethyl)prop-2-enamide Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-(2-thienylmethyl)prop-2-enamide CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-(thiophen-2-ylmethyl)-2-propenamide IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-(thiophen-2-ylmethyl)prop-2-enamide Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-(2-thenyl)acrylamide Formula: C16H12N2O3S MolecularWeight: 312.34308

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C(C#N)C(=O)NCC3=CC=CS3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C(\C#N)/C(=O)NCC3=CC=CS3

InChI

InChI=1S/C16H12N2O3S/c17-8-12(16(19)18-9-13-2-1-5-22-13)6-11-3-4-14-15(7-11)21-10-20-14/h1-7H,9-10H2,(H,18,19)/b12-6+