1-[2-[(3-chloranylpyridin-2-yl)methylsulfanyl]ethyl]-1-(phenylsulfonyl)-2-prop-2-ynyl-guanidine

Systemtic Name: 1-[2-[(3-chloranylpyridin-2-yl)methylsulfanyl]ethyl]-1-(phenylsulfonyl)-2-prop-2-ynyl-guanidine Openeye Name: 1-(benzenesulfonyl)-1-[2-[(3-chloro-2-pyridyl)methylsulfanyl]ethyl]-2-prop-2-ynyl-guanidine CAS Name: 1-(benzenesulfonyl)-1-[2-[(3-chloro-2-pyridinyl)methylthio]ethyl]-2-prop-2-ynylguanidine IUPAC Name: 1-(benzenesulfonyl)-1-[2-[(3-chloropyridin-2-yl)methylsulfanyl]ethyl]-2-prop-2-ynylguanidine Traditional Name: 1-besyl-1-[2-[(3-chloro-2-pyridyl)methylthio]ethyl]-2-propargyl-guanidine Formula: C18H19ClN4O2S2 MolecularWeight: 422.95206

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN=C(N)N(CCSCC1=C(C=CC=N1)Cl)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C#CCN=C(N)N(CCSCC1=C(C=CC=N1)Cl)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H19ClN4O2S2/c1-2-10-22-18(20)23(27(24,25)15-7-4-3-5-8-15)12-13-26-14-17-16(19)9-6-11-21-17/h1,3-9,11H,10,12-14H2,(H2,20,22)