(E)-3-anthracen-9-yl-2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)prop-2-enamide

Systemtic Name: (E)-3-anthracen-9-yl-2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)prop-2-enamide Openeye Name: (E)-3-(9-anthryl)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)prop-2-enamide CAS Name: (E)-3-(9-anthracenyl)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-propenamide IUPAC Name: (E)-3-anthracen-9-yl-2-cyano-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)prop-2-enamide Traditional Name: (E)-3-(9-anthryl)-2-cyano-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)acrylamide Formula: C27H19N3OS MolecularWeight: 433.52426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C(=CC3=C4C=CC=CC4=CC5=CC=CC=C53)C#N)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)/C(=C/C3=C4C=CC=CC4=CC5=CC=CC=C53)/C#N)C#N

InChI

InChI=1S/C27H19N3OS/c28-15-19(26(31)30-27-24(16-29)22-11-5-6-12-25(22)32-27)14-23-20-9-3-1-7-17(20)13-18-8-2-4-10-21(18)23/h1-4,7-10,13-14H,5-6,11-12H2,(H,30,31)/b19-14+