(E)-2-(5-chloranyl-1,3-benzothiazol-2-yl)-3-(4-dimethylaminophenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(5-chloranyl-1,3-benzothiazol-2-yl)-3-(4-dimethylaminophenyl)prop-2-enenitrile Openeye Name: (E)-2-(5-chloro-1,3-benzothiazol-2-yl)-3-(4-dimethylaminophenyl)prop-2-enenitrile CAS Name: (E)-2-(5-chloro-1,3-benzothiazol-2-yl)-3-(4-dimethylaminophenyl)-2-propenenitrile IUPAC Name: (E)-2-(5-chloro-1,3-benzothiazol-2-yl)-3-(4-dimethylaminophenyl)prop-2-enenitrile Traditional Name: (E)-2-(5-chloro-1,3-benzothiazol-2-yl)-3-(4-dimethylaminophenyl)acrylonitrile Formula: C18H14ClN3S MolecularWeight: 339.84186

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=C(C#N)C2=NC3=C(S2)C=CC(=C3)Cl

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=C(\C#N)/C2=NC3=C(S2)C=CC(=C3)Cl

InChI

InChI=1S/C18H14ClN3S/c1-22(2)15-6-3-12(4-7-15)9-13(11-20)18-21-16-10-14(19)5-8-17(16)23-18/h3-10H,1-2H3/b13-9+