4-tert-butyl-N-[5-[(2-methoxyphenyl)methyl]-6-(3-oxidanylidene-3-thiophen-3-yl-propoxy)pyrimidin-4-yl]benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-[5-[(2-methoxyphenyl)methyl]-6-(3-oxidanylidene-3-thiophen-3-yl-propoxy)pyrimidin-4-yl]benzenesulfonamide Openeye Name: 4-tert-butyl-N-[5-[(2-methoxyphenyl)methyl]-6-[3-oxo-3-(3-thienyl)propoxy]pyrimidin-4-yl]benzenesulfonamide CAS Name: 4-tert-butyl-N-[5-[(2-methoxyphenyl)methyl]-6-[3-oxo-3-(3-thiophenyl)propoxy]-4-pyrimidinyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-[5-[(2-methoxyphenyl)methyl]-6-(3-oxo-3-thiophen-3-ylpropoxy)pyrimidin-4-yl]benzenesulfonamide Traditional Name: 4-tert-butyl-N-[6-[3-keto-3-(3-thienyl)propoxy]-5-o-anisyl-pyrimidin-4-yl]benzenesulfonamide Formula: C29H31N3O5S2 MolecularWeight: 565.70354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC=N2)OCCC(=O)C3=CSC=C3)CC4=CC=CC=C4OC

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)NC2=C(C(=NC=N2)OCCC(=O)C3=CSC=C3)CC4=CC=CC=C4OC

InChI

InChI=1S/C29H31N3O5S2/c1-29(2,3)22-9-11-23(12-10-22)39(34,35)32-27-24(17-20-7-5-6-8-26(20)36-4)28(31-19-30-27)37-15-13-25(33)21-14-16-38-18-21/h5-12,14,16,18-19H,13,15,17H2,1-4H3,(H,30,31,32)