3-[[(3S)-3-[[4-(1-methylimidazol-2-yl)phenyl]sulfonylamino]-2-oxidanylidene-pyrrolidin-1-yl]methyl]benzenecarboximidamide

Systemtic Name: 3-[[(3S)-3-[[4-(1-methylimidazol-2-yl)phenyl]sulfonylamino]-2-oxidanylidene-pyrrolidin-1-yl]methyl]benzenecarboximidamide Openeye Name: 3-[[(3S)-3-[[4-(1-methylimidazol-2-yl)phenyl]sulfonylamino]-2-oxo-pyrrolidin-1-yl]methyl]benzamidine CAS Name: 3-[[(3S)-3-[[4-(1-methyl-2-imidazolyl)phenyl]sulfonylamino]-2-oxo-1-pyrrolidinyl]methyl]benzenecarboximidamide IUPAC Name: 3-[[(3S)-3-[[4-(1-methylimidazol-2-yl)phenyl]sulfonylamino]-2-oxopyrrolidin-1-yl]methyl]benzenecarboximidamide Traditional Name: 3-[[(3S)-2-keto-3-[[4-(1-methylimidazol-2-yl)phenyl]sulfonylamino]pyrrolidino]methyl]benzamidine Formula: C22H24N6O3S MolecularWeight: 452.52936

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C2=CC=C(C=C2)S(=O)(=O)NC3CCN(C3=O)CC4=CC=CC(=C4)C(=N)N

Isomeric SMILES

CN1C=CN=C1C2=CC=C(C=C2)S(=O)(=O)N[C@H]3CCN(C3=O)CC4=CC=CC(=C4)C(=N)N

InChI

InChI=1S/C22H24N6O3S/c1-27-12-10-25-21(27)16-5-7-18(8-6-16)32(30,31)26-19-9-11-28(22(19)29)14-15-3-2-4-17(13-15)20(23)24/h2-8,10,12-13,19,26H,9,11,14H2,1H3,(H3,23,24)/t19-/m0/s1