1-cyano-2-[(E)-3-phenylprop-2-enyl]-1-[3-(1,3-thiazol-4-ylmethylsulfanyl)propyl]guanidine

Systemtic Name: 1-cyano-2-[(E)-3-phenylprop-2-enyl]-1-[3-(1,3-thiazol-4-ylmethylsulfanyl)propyl]guanidine Openeye Name: 2-[(E)-cinnamyl]-1-cyano-1-[3-(thiazol-4-ylmethylsulfanyl)propyl]guanidine CAS Name: 1-cyano-2-[(E)-3-phenylprop-2-enyl]-1-[3-(4-thiazolylmethylthio)propyl]guanidine IUPAC Name: 1-cyano-2-[(E)-3-phenylprop-2-enyl]-1-[3-(1,3-thiazol-4-ylmethylsulfanyl)propyl]guanidine Traditional Name: 2-[(E)-cinnamyl]-1-cyano-1-[3-(thiazol-4-ylmethylthio)propyl]guanidine Formula: C18H21N5S2 MolecularWeight: 371.52284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CCN=C(N)N(CCCSCC2=CSC=N2)C#N

Isomeric SMILES

C1=CC=C(C=C1)/C=C/CN=C(N)N(CCCSCC2=CSC=N2)C#N

InChI

InChI=1S/C18H21N5S2/c19-14-23(10-5-11-24-12-17-13-25-15-22-17)18(20)21-9-4-8-16-6-2-1-3-7-16/h1-4,6-8,13,15H,5,9-12H2,(H2,20,21)/b8-4+