[[(6-morpholin-4-ylpyrimidin-4-yl)amino]-phenyl-methylidene]-(phenylsulfonyl)azanium

Systemtic Name: [[(6-morpholin-4-ylpyrimidin-4-yl)amino]-phenyl-methylidene]-(phenylsulfonyl)azanium Openeye Name: benzenesulfonyl-[[(6-morpholinopyrimidin-4-yl)amino]-phenyl-methylene]ammonium CAS Name: benzenesulfonyl-[[[6-(4-morpholinyl)-4-pyrimidinyl]amino]-phenylmethylidene]ammonium IUPAC Name: benzenesulfonyl-[[(6-morpholin-4-ylpyrimidin-4-yl)amino]-phenylmethylidene]azanium Traditional Name: besyl-[[(6-morpholinopyrimidin-4-yl)amino]-phenyl-methylene]ammonium Formula: C21H22N5O3S+ MolecularWeight: 424.49608

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC(=NC=N2)NC(=[NH+]S(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1C2=CC(=NC=N2)NC(=[NH+]S(=O)(=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H21N5O3S/c27-30(28,18-9-5-2-6-10-18)25-21(17-7-3-1-4-8-17)24-19-15-20(23-16-22-19)26-11-13-29-14-12-26/h1-10,15-16H,11-14H2,(H,22,23,24,25)/p+1