1-[2-[(5-azanyl-1,3,4-thiadiazol-2-yl)methylsulfanyl]ethyl]-2-methyl-1-(phenylsulfonyl)guanidine

Systemtic Name: 1-[2-[(5-azanyl-1,3,4-thiadiazol-2-yl)methylsulfanyl]ethyl]-2-methyl-1-(phenylsulfonyl)guanidine Openeye Name: 1-[2-[(5-amino-1,3,4-thiadiazol-2-yl)methylsulfanyl]ethyl]-1-(benzenesulfonyl)-2-methyl-guanidine CAS Name: 1-[2-[(5-amino-1,3,4-thiadiazol-2-yl)methylthio]ethyl]-1-(benzenesulfonyl)-2-methylguanidine IUPAC Name: 1-[2-[(5-amino-1,3,4-thiadiazol-2-yl)methylsulfanyl]ethyl]-1-(benzenesulfonyl)-2-methylguanidine Traditional Name: 1-[2-[(5-amino-1,3,4-thiadiazol-2-yl)methylthio]ethyl]-1-besyl-2-methyl-guanidine Formula: C13H18N6O2S3 MolecularWeight: 386.51602

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(N)N(CCSCC1=NN=C(S1)N)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CN=C(N)N(CCSCC1=NN=C(S1)N)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H18N6O2S3/c1-16-12(14)19(24(20,21)10-5-3-2-4-6-10)7-8-22-9-11-17-18-13(15)23-11/h2-6H,7-9H2,1H3,(H2,14,16)(H2,15,18)