4-[[4-(1-benzothiophen-2-yl)pyrimidin-2-yl]-methyl-amino]benzenesulfonamide

Systemtic Name: 4-[[4-(1-benzothiophen-2-yl)pyrimidin-2-yl]-methyl-amino]benzenesulfonamide Openeye Name: 4-[[4-(benzothiophen-2-yl)pyrimidin-2-yl]-methyl-amino]benzenesulfonamide CAS Name: 4-[[4-(1-benzothiophen-2-yl)-2-pyrimidinyl]-methylamino]benzenesulfonamide IUPAC Name: 4-[[4-(1-benzothiophen-2-yl)pyrimidin-2-yl]-methylamino]benzenesulfonamide Traditional Name: 4-[[4-(benzothiophen-2-yl)pyrimidin-2-yl]-methyl-amino]benzenesulfonamide Formula: C19H16N4O2S2 MolecularWeight: 396.48594

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)S(=O)(=O)N)C2=NC=CC(=N2)C3=CC4=CC=CC=C4S3

Isomeric SMILES

CN(C1=CC=C(C=C1)S(=O)(=O)N)C2=NC=CC(=N2)C3=CC4=CC=CC=C4S3

InChI

InChI=1S/C19H16N4O2S2/c1-23(14-6-8-15(9-7-14)27(20,24)25)19-21-11-10-16(22-19)18-12-13-4-2-3-5-17(13)26-18/h2-12H,1H3,(H2,20,24,25)