(E)-3-methylsulfanyl-3-[(phenylmethyl)amino]prop-2-enenitrile

Systemtic Name: (E)-3-methylsulfanyl-3-[(phenylmethyl)amino]prop-2-enenitrile Openeye Name: (E)-3-(benzylamino)-3-methylsulfanyl-prop-2-enenitrile CAS Name: (E)-3-(methylthio)-3-[(phenylmethyl)amino]-2-propenenitrile IUPAC Name: (E)-3-(benzylamino)-3-methylsulfanylprop-2-enenitrile Traditional Name: (E)-3-(benzylamino)-3-(methylthio)acrylonitrile Formula: C11H12N2S MolecularWeight: 204.29138

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=CC#N)NCC1=CC=CC=C1

Isomeric SMILES

CS/C(=C/C#N)/NCC1=CC=CC=C1

InChI

InChI=1S/C11H12N2S/c1-14-11(7-8-12)13-9-10-5-3-2-4-6-10/h2-7,13H,9H2,1H3/b11-7+