N-(3-methoxypropyl)-4-[[4-(3-methylimidazol-4-yl)pyrimidin-2-yl]amino]benzenesulfonamide

Systemtic Name: N-(3-methoxypropyl)-4-[[4-(3-methylimidazol-4-yl)pyrimidin-2-yl]amino]benzenesulfonamide Openeye Name: N-(3-methoxypropyl)-4-[[4-(3-methylimidazol-4-yl)pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: N-(3-methoxypropyl)-4-[[4-(3-methyl-4-imidazolyl)-2-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: N-(3-methoxypropyl)-4-[[4-(3-methylimidazol-4-yl)pyrimidin-2-yl]amino]benzenesulfonamide Traditional Name: N-(3-methoxypropyl)-4-[[4-(3-methylimidazol-4-yl)pyrimidin-2-yl]amino]benzenesulfonamide Formula: C18H22N6O3S MolecularWeight: 402.47068

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1C2=NC(=NC=C2)NC3=CC=C(C=C3)S(=O)(=O)NCCCOC

Isomeric SMILES

CN1C=NC=C1C2=NC(=NC=C2)NC3=CC=C(C=C3)S(=O)(=O)NCCCOC

InChI

InChI=1S/C18H22N6O3S/c1-24-13-19-12-17(24)16-8-10-20-18(23-16)22-14-4-6-15(7-5-14)28(25,26)21-9-3-11-27-2/h4-8,10,12-13,21H,3,9,11H2,1-2H3,(H,20,22,23)