1-[2-[(3-chloranylpyridin-2-yl)methylsulfanyl]ethyl]-1-(4-methylphenyl)sulfonyl-2-prop-2-ynyl-guanidine

Systemtic Name: 1-[2-[(3-chloranylpyridin-2-yl)methylsulfanyl]ethyl]-1-(4-methylphenyl)sulfonyl-2-prop-2-ynyl-guanidine Openeye Name: 1-[2-[(3-chloro-2-pyridyl)methylsulfanyl]ethyl]-2-prop-2-ynyl-1-(p-tolylsulfonyl)guanidine CAS Name: 1-[2-[(3-chloro-2-pyridinyl)methylthio]ethyl]-1-(4-methylphenyl)sulfonyl-2-prop-2-ynylguanidine IUPAC Name: 1-[2-[(3-chloropyridin-2-yl)methylsulfanyl]ethyl]-1-(4-methylphenyl)sulfonyl-2-prop-2-ynylguanidine Traditional Name: 1-[2-[(3-chloro-2-pyridyl)methylthio]ethyl]-2-propargyl-1-tosyl-guanidine Formula: C19H21ClN4O2S2 MolecularWeight: 436.97864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CCSCC2=C(C=CC=N2)Cl)C(=NCC#C)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CCSCC2=C(C=CC=N2)Cl)C(=NCC#C)N

InChI

InChI=1S/C19H21ClN4O2S2/c1-3-10-23-19(21)24(28(25,26)16-8-6-15(2)7-9-16)12-13-27-14-18-17(20)5-4-11-22-18/h1,4-9,11H,10,12-14H2,2H3,(H2,21,23)