5-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]pentanenitrile

Systemtic Name: 5-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]pentanenitrile Openeye Name: 5-[(4-allyl-1,2,4-triazol-3-yl)sulfanyl]pentanenitrile CAS Name: 5-[(4-prop-2-enyl-1,2,4-triazol-3-yl)thio]pentanenitrile IUPAC Name: 5-[(4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]pentanenitrile Traditional Name: 5-[(4-allyl-1,2,4-triazol-3-yl)thio]valeronitrile Formula: C10H14N4S MolecularWeight: 222.30996

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C=NN=C1SCCCCC#N

Isomeric SMILES

C=CCN1C=NN=C1SCCCCC#N

InChI

InChI=1S/C10H14N4S/c1-2-7-14-9-12-13-10(14)15-8-5-3-4-6-11/h2,9H,1,3-5,7-8H2