4-tert-butyl-N-[6-ethoxy-5-(2-methoxyphenyl)sulfanyl-2-pyrimidin-2-yl-pyrimidin-4-yl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[6-ethoxy-5-(2-methoxyphenyl)sulfanyl-2-pyrimidin-2-yl-pyrimidin-4-yl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[6-ethoxy-5-(2-methoxyphenyl)sulfanyl-2-pyrimidin-2-yl-pyrimidin-4-yl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[6-ethoxy-5-[(2-methoxyphenyl)thio]-2-(2-pyrimidinyl)-4-pyrimidinyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[6-ethoxy-5-(2-methoxyphenyl)sulfanyl-2-pyrimidin-2-ylpyrimidin-4-yl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[6-ethoxy-5-[(2-methoxyphenyl)thio]-2-(2-pyrimidyl)pyrimidin-4-yl]benzenesulfonamide Formula: C27H29N5O4S2 MolecularWeight: 551.68026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NC(=NC(=C1SC2=CC=CC=C2OC)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C)C4=NC=CC=N4

Isomeric SMILES

CCOC1=NC(=NC(=C1SC2=CC=CC=C2OC)NS(=O)(=O)C3=CC=C(C=C3)C(C)(C)C)C4=NC=CC=N4

InChI

InChI=1S/C27H29N5O4S2/c1-6-36-26-22(37-21-11-8-7-10-20(21)35-5)23(30-25(31-26)24-28-16-9-17-29-24)32-38(33,34)19-14-12-18(13-15-19)27(2,3)4/h7-17H,6H2,1-5H3,(H,30,31,32)