2-methyl-1-(phenylsulfonyl)-3-[2-(quinolin-2-ylmethylsulfanyl)ethyl]guanidine

Systemtic Name: 2-methyl-1-(phenylsulfonyl)-3-[2-(quinolin-2-ylmethylsulfanyl)ethyl]guanidine Openeye Name: 1-(benzenesulfonyl)-2-methyl-3-[2-(2-quinolylmethylsulfanyl)ethyl]guanidine CAS Name: 1-(benzenesulfonyl)-2-methyl-3-[2-(2-quinolinylmethylthio)ethyl]guanidine IUPAC Name: 1-(benzenesulfonyl)-2-methyl-3-[2-(quinolin-2-ylmethylsulfanyl)ethyl]guanidine Traditional Name: 1-besyl-2-methyl-3-[2-(2-quinolylmethylthio)ethyl]guanidine Formula: C20H22N4O2S2 MolecularWeight: 414.54428

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(NCCSCC1=NC2=CC=CC=C2C=C1)NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN=C(NCCSCC1=NC2=CC=CC=C2C=C1)NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H22N4O2S2/c1-21-20(24-28(25,26)18-8-3-2-4-9-18)22-13-14-27-15-17-12-11-16-7-5-6-10-19(16)23-17/h2-12H,13-15H2,1H3,(H2,21,22,24)