3-[[4-[(E)-3-(5-chloranylthiophen-2-yl)-3-oxidanylidene-prop-1-enyl]phenyl]-methyl-amino]propanenitrile

Systemtic Name: 3-[[4-[(E)-3-(5-chloranylthiophen-2-yl)-3-oxidanylidene-prop-1-enyl]phenyl]-methyl-amino]propanenitrile Openeye Name: 3-[4-[(E)-3-(5-chloro-2-thienyl)-3-oxo-prop-1-enyl]-N-methyl-anilino]propanenitrile CAS Name: 3-[4-[(E)-3-(5-chloro-2-thiophenyl)-3-oxoprop-1-enyl]-N-methylanilino]propanenitrile IUPAC Name: 3-[4-[(E)-3-(5-chlorothiophen-2-yl)-3-oxoprop-1-enyl]-N-methylanilino]propanenitrile Traditional Name: 3-[4-[(E)-3-(5-chloro-2-thienyl)-3-keto-prop-1-enyl]-N-methyl-anilino]propionitrile Formula: C17H15ClN2OS MolecularWeight: 330.8318

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC#N)C1=CC=C(C=C1)C=CC(=O)C2=CC=C(S2)Cl

Isomeric SMILES

CN(CCC#N)C1=CC=C(C=C1)/C=C/C(=O)C2=CC=C(S2)Cl

InChI

InChI=1S/C17H15ClN2OS/c1-20(12-2-11-19)14-6-3-13(4-7-14)5-8-15(21)16-9-10-17(18)22-16/h3-10H,2,12H2,1H3/b8-5+