3-[(3R,4S)-4-ethanoyl-1-[[4-(2-sulfamoylphenyl)phenyl]methyl]pyrrolidin-3-yl]benzenecarboximidamide

Systemtic Name: 3-[(3R,4S)-4-ethanoyl-1-[[4-(2-sulfamoylphenyl)phenyl]methyl]pyrrolidin-3-yl]benzenecarboximidamide Openeye Name: 3-[(3R,4S)-4-acetyl-1-[[4-(2-sulfamoylphenyl)phenyl]methyl]pyrrolidin-3-yl]benzamidine CAS Name: 3-[(3R,4S)-4-acetyl-1-[[4-(2-sulfamoylphenyl)phenyl]methyl]-3-pyrrolidinyl]benzenecarboximidamide IUPAC Name: 3-[(3R,4S)-4-acetyl-1-[[4-(2-sulfamoylphenyl)phenyl]methyl]pyrrolidin-3-yl]benzenecarboximidamide Traditional Name: 3-[(3R,4S)-4-acetyl-1-[4-(2-sulfamoylphenyl)benzyl]pyrrolidin-3-yl]benzamidine Formula: C26H28N4O3S MolecularWeight: 476.59052

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1CN(CC1C2=CC=CC(=C2)C(=N)N)CC3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)N

Isomeric SMILES

CC(=O)[C@@H]1CN(C[C@H]1C2=CC=CC(=C2)C(=N)N)CC3=CC=C(C=C3)C4=CC=CC=C4S(=O)(=O)N

InChI

InChI=1S/C26H28N4O3S/c1-17(31)23-15-30(16-24(23)20-5-4-6-21(13-20)26(27)28)14-18-9-11-19(12-10-18)22-7-2-3-8-25(22)34(29,32)33/h2-13,23-24H,14-16H2,1H3,(H3,27,28)(H2,29,32,33)/t23-,24-/m0/s1