3-butyl-1-benzothiophene-5-carbonitrile

Systemtic Name: 3-butyl-1-benzothiophene-5-carbonitrile Openeye Name: 3-butylbenzothiophene-5-carbonitrile CAS Name: 3-butyl-1-benzothiophene-5-carbonitrile IUPAC Name: 3-butyl-1-benzothiophene-5-carbonitrile Traditional Name: 3-butylbenzothiophene-5-carbonitrile Formula: C13H13NS MolecularWeight: 215.31402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CSC2=C1C=C(C=C2)C#N

Isomeric SMILES

CCCCC1=CSC2=C1C=C(C=C2)C#N

InChI

InChI=1S/C13H13NS/c1-2-3-4-11-9-15-13-6-5-10(8-14)7-12(11)13/h5-7,9H,2-4H2,1H3