2-[[[3-(phenylcarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]methylidene]propanedinitrile

Systemtic Name: 2-[[[3-(phenylcarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]methylidene]propanedinitrile Openeye Name: 2-[[(3-benzoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]methylene]propanedinitrile CAS Name: 2-[[(3-benzoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]methylidene]propanedinitrile IUPAC Name: 2-[[(3-benzoyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]methylidene]propanedinitrile Traditional Name: 2-[[(3-benzoyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]methylene]malononitrile Formula: C19H15N3OS MolecularWeight: 333.4069

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC=C(C#N)C#N)C(=O)C3=CC=CC=C3

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC=C(C#N)C#N)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H15N3OS/c20-10-13(11-21)12-22-19-17(15-8-4-5-9-16(15)24-19)18(23)14-6-2-1-3-7-14/h1-3,6-7,12,22H,4-5,8-9H2