3-[(3-chloranyl-1-benzothiophen-2-yl)-phenyl-amino]propanenitrile

Systemtic Name: 3-[(3-chloranyl-1-benzothiophen-2-yl)-phenyl-amino]propanenitrile Openeye Name: 3-(N-(3-chlorobenzothiophen-2-yl)anilino)propanenitrile CAS Name: 3-(N-(3-chloro-1-benzothiophen-2-yl)anilino)propanenitrile IUPAC Name: 3-(N-(3-chloro-1-benzothiophen-2-yl)anilino)propanenitrile Traditional Name: 3-(N-(3-chlorobenzothiophen-2-yl)anilino)propionitrile Formula: C17H13ClN2S MolecularWeight: 312.81652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCC#N)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

C1=CC=C(C=C1)N(CCC#N)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C17H13ClN2S/c18-16-14-9-4-5-10-15(14)21-17(16)20(12-6-11-19)13-7-2-1-3-8-13/h1-5,7-10H,6,12H2