2-[3-[6-[hydroxymethyl(2-oxidanylideneethyl)sulfamoyl]-7-methyl-5-pyrrolidin-1-yl-8-sulfanylidene-5H-naphthalen-1-yl]propyl]guanidine

Systemtic Name: 2-[3-[6-[hydroxymethyl(2-oxidanylideneethyl)sulfamoyl]-7-methyl-5-pyrrolidin-1-yl-8-sulfanylidene-5H-naphthalen-1-yl]propyl]guanidine Openeye Name: 2-[3-[6-[hydroxymethyl(2-oxoethyl)sulfamoyl]-7-methyl-5-pyrrolidin-1-yl-8-thioxo-5H-naphthalen-1-yl]propyl]guanidine CAS Name: 2-[3-[6-[hydroxymethyl(2-oxoethyl)sulfamoyl]-7-methyl-5-(1-pyrrolidinyl)-8-sulfanylidene-5H-naphthalen-1-yl]propyl]guanidine IUPAC Name: 2-[3-[6-[hydroxymethyl(2-oxoethyl)sulfamoyl]-7-methyl-5-pyrrolidin-1-yl-8-sulfanylidene-5H-naphthalen-1-yl]propyl]guanidine Traditional Name: 2-[3-[6-[2-ketoethyl(methylol)sulfamoyl]-7-methyl-5-pyrrolidino-8-thioxo-5H-naphthalen-1-yl]propyl]guanidine Formula: C22H31N5O4S2 MolecularWeight: 493.64264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(C1=S)C(=CC=C2)CCCN=C(N)N)N3CCCC3)S(=O)(=O)N(CC=O)CO

Isomeric SMILES

CC1=C(C(C2=C(C1=S)C(=CC=C2)CCCN=C(N)N)N3CCCC3)S(=O)(=O)N(CC=O)CO

InChI

InChI=1S/C22H31N5O4S2/c1-15-20(32)18-16(7-5-9-25-22(23)24)6-4-8-17(18)19(26-10-2-3-11-26)21(15)33(30,31)27(14-29)12-13-28/h4,6,8,13,19,29H,2-3,5,7,9-12,14H2,1H3,(H4,23,24,25)