3-[[4-[2-(ethylamino)-4-methyl-1,3-thiazol-5-yl]pyrimidin-2-yl]amino]benzenesulfonamide

Systemtic Name: 3-[[4-[2-(ethylamino)-4-methyl-1,3-thiazol-5-yl]pyrimidin-2-yl]amino]benzenesulfonamide Openeye Name: 3-[[4-[2-(ethylamino)-4-methyl-thiazol-5-yl]pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: 3-[[4-[2-(ethylamino)-4-methyl-5-thiazolyl]-2-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: 3-[[4-[2-(ethylamino)-4-methyl-1,3-thiazol-5-yl]pyrimidin-2-yl]amino]benzenesulfonamide Traditional Name: 3-[[4-[2-(ethylamino)-4-methyl-thiazol-5-yl]pyrimidin-2-yl]amino]benzenesulfonamide Formula: C16H18N6O2S2 MolecularWeight: 390.48312

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC(=C(S1)C2=NC(=NC=C2)NC3=CC(=CC=C3)S(=O)(=O)N)C

Isomeric SMILES

CCNC1=NC(=C(S1)C2=NC(=NC=C2)NC3=CC(=CC=C3)S(=O)(=O)N)C

InChI

InChI=1S/C16H18N6O2S2/c1-3-18-16-20-10(2)14(25-16)13-7-8-19-15(22-13)21-11-5-4-6-12(9-11)26(17,23)24/h4-9H,3H2,1-2H3,(H,18,20)(H2,17,23,24)(H,19,21,22)