N-azanyl-N'-[3-azanyl-2-heptanoyl-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-heptanoyl-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-heptanoyl-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-oxoheptyl)-5-(1-pyrrolidinyl)-7-sulfamoyl-1-naphthalenyl]methanimidamide IUPAC Name: N-amino-N'-[3-amino-2-heptanoyl-8-(hydroxymethyl)-4-methyl-6-(2-oxoethyl)-5-pyrrolidin-1-yl-7-sulfamoylnaphthalen-1-yl]methanimidamide Traditional Name: N-amino-N'-[3-amino-2-enanthyl-6-(2-ketoethyl)-4-methyl-8-methylol-5-pyrrolidino-7-sulfamoyl-1-naphthyl]formamidine Formula: C26H38N6O5S MolecularWeight: 546.68212

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H38N6O5S/c1-3-4-5-6-9-19(35)22-23(27)16(2)20-21(24(22)30-15-31-28)18(14-34)26(38(29,36)37)17(10-13-33)25(20)32-11-7-8-12-32/h13,15,34H,3-12,14,27-28H2,1-2H3,(H,30,31)(H2,29,36,37)