2-[(E)-(5-bromanyl-2-prop-2-enoxy-phenyl)methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile

Systemtic Name: 2-[(E)-(5-bromanyl-2-prop-2-enoxy-phenyl)methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Openeye Name: 2-[(E)-(2-allyloxy-5-bromo-phenyl)methyleneamino]-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile CAS Name: 2-[(E)-(5-bromo-2-prop-2-enoxyphenyl)methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile IUPAC Name: 2-[(E)-(5-bromo-2-prop-2-enoxyphenyl)methylideneamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carbonitrile Traditional Name: 2-[(E)-(2-allyloxy-5-bromo-benzylidene)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carbonitrile Formula: C19H17BrN2OS MolecularWeight: 401.32008

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=C(C=C(C=C1)Br)C=NC2=C(C3=C(S2)CCCC3)C#N

Isomeric SMILES

C=CCOC1=C(C=C(C=C1)Br)/C=N/C2=C(C3=C(S2)CCCC3)C#N

InChI

InChI=1S/C19H17BrN2OS/c1-2-9-23-17-8-7-14(20)10-13(17)12-22-19-16(11-21)15-5-3-4-6-18(15)24-19/h2,7-8,10,12H,1,3-6,9H2/b22-12+