2-(1,3-benzothiazol-2-ylsulfanyl)-3-(5-chloranyl-2-ethoxy-phenyl)prop-2-enenitrile

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-(5-chloranyl-2-ethoxy-phenyl)prop-2-enenitrile Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-(5-chloro-2-ethoxy-phenyl)prop-2-enenitrile CAS Name: 2-(1,3-benzothiazol-2-ylthio)-3-(5-chloro-2-ethoxyphenyl)-2-propenenitrile IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-3-(5-chloro-2-ethoxyphenyl)prop-2-enenitrile Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-3-(5-chloro-2-ethoxy-phenyl)acrylonitrile Formula: C18H13ClN2OS2 MolecularWeight: 372.89162

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Cl)C=C(C#N)SC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCOC1=C(C=C(C=C1)Cl)C=C(C#N)SC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H13ClN2OS2/c1-2-22-16-8-7-13(19)9-12(16)10-14(11-20)23-18-21-15-5-3-4-6-17(15)24-18/h3-10H,2H2,1H3