N-azanyl-N'-[3-azanyl-2-hexanoyl-8-(hydroxymethyl)-4-methyl-6-(2-oxidanylideneethyl)-5-pyrrolidin-1-yl-7-sulfamoyl-naphthalen-1-yl]methanimidamide

Systemtic Name: N-azanyl-N'-[3-azanyl-2-hexanoyl-8-(hydroxymethyl)-4-methyl-6-(2-oxidanylideneethyl)-5-pyrrolidin-1-yl-7-sulfamoyl-naphthalen-1-yl]methanimidamide Openeye Name: N-amino-N'-[3-amino-2-hexanoyl-8-(hydroxymethyl)-4-methyl-6-(2-oxoethyl)-5-pyrrolidin-1-yl-7-sulfamoyl-1-naphthyl]formamidine CAS Name: N-amino-N'-[3-amino-8-(hydroxymethyl)-4-methyl-6-(2-oxoethyl)-2-(1-oxohexyl)-5-(1-pyrrolidinyl)-7-sulfamoyl-1-naphthalenyl]methanimidamide IUPAC Name: N-amino-N'-[3-amino-2-hexanoyl-8-(hydroxymethyl)-4-methyl-6-(2-oxoethyl)-5-pyrrolidin-1-yl-7-sulfamoylnaphthalen-1-yl]methanimidamide Traditional Name: N-amino-N'-[3-amino-2-caproyl-6-(2-ketoethyl)-4-methyl-8-methylol-5-pyrrolidino-7-sulfamoyl-1-naphthyl]formamidine Formula: C25H36N6O5S MolecularWeight: 532.65554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C1=C(C2=C(C(=C1N)C)C(=C(C(=C2CO)S(=O)(=O)N)CC=O)N3CCCC3)N=CNN

Isomeric SMILES

CCCCCC(=O)C1=C(C2=C(C(=C1N)C)C(=C(C(=C2CO)S(=O)(=O)N)CC=O)N3CCCC3)N=CNN

InChI

InChI=1S/C25H36N6O5S/c1-3-4-5-8-18(34)21-22(26)15(2)19-20(23(21)29-14-30-27)17(13-33)25(37(28,35)36)16(9-12-32)24(19)31-10-6-7-11-31/h12,14,33H,3-11,13,26-27H2,1-2H3,(H,29,30)(H2,28,35,36)