N-[4-[[6-(diethylamino)-2-methyl-pyrimidin-4-yl]amino]phenyl]thiophene-2-sulfonamide

Systemtic Name: N-[4-[[6-(diethylamino)-2-methyl-pyrimidin-4-yl]amino]phenyl]thiophene-2-sulfonamide Openeye Name: N-[4-[[6-(diethylamino)-2-methyl-pyrimidin-4-yl]amino]phenyl]thiophene-2-sulfonamide CAS Name: N-[4-[[6-(diethylamino)-2-methyl-4-pyrimidinyl]amino]phenyl]-2-thiophenesulfonamide IUPAC Name: N-[4-[[6-(diethylamino)-2-methylpyrimidin-4-yl]amino]phenyl]thiophene-2-sulfonamide Traditional Name: N-[4-[[6-(diethylamino)-2-methyl-pyrimidin-4-yl]amino]phenyl]thiophene-2-sulfonamide Formula: C19H23N5O2S2 MolecularWeight: 417.54822

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC(=NC(=C1)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CS3)C

Isomeric SMILES

CCN(CC)C1=NC(=NC(=C1)NC2=CC=C(C=C2)NS(=O)(=O)C3=CC=CS3)C

InChI

InChI=1S/C19H23N5O2S2/c1-4-24(5-2)18-13-17(20-14(3)21-18)22-15-8-10-16(11-9-15)23-28(25,26)19-7-6-12-27-19/h6-13,23H,4-5H2,1-3H3,(H,20,21,22)