2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(6-methyl-1,3-benzodioxol-5-yl)prop-2-enamide

Systemtic Name: 2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(6-methyl-1,3-benzodioxol-5-yl)prop-2-enamide Openeye Name: 2-cyano-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(6-methyl-1,3-benzodioxol-5-yl)prop-2-enamide CAS Name: 2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(6-methyl-1,3-benzodioxol-5-yl)-2-propenamide IUPAC Name: 2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(6-methyl-1,3-benzodioxol-5-yl)prop-2-enamide Traditional Name: 2-cyano-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(6-methyl-1,3-benzodioxol-5-yl)acrylamide Formula: C21H17N3O3S MolecularWeight: 391.44298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C=C(C#N)C(=O)NC3=C(C4=C(S3)CCCC4)C#N)OCO2

Isomeric SMILES

CC1=CC2=C(C=C1C=C(C#N)C(=O)NC3=C(C4=C(S3)CCCC4)C#N)OCO2

InChI

InChI=1S/C21H17N3O3S/c1-12-6-17-18(27-11-26-17)8-13(12)7-14(9-22)20(25)24-21-16(10-23)15-4-2-3-5-19(15)28-21/h6-8H,2-5,11H2,1H3,(H,24,25)