2-[bis[2-(4-hydroxyphenyl)sulfanylethyl]amino]-N-pyrimidin-2-yl-ethanamide

Systemtic Name: 2-[bis[2-(4-hydroxyphenyl)sulfanylethyl]amino]-N-pyrimidin-2-yl-ethanamide Openeye Name: 2-[bis[2-(4-hydroxyphenyl)sulfanylethyl]amino]-N-pyrimidin-2-yl-acetamide CAS Name: 2-[bis[2-[(4-hydroxyphenyl)thio]ethyl]amino]-N-(2-pyrimidinyl)acetamide IUPAC Name: 2-[bis[2-(4-hydroxyphenyl)sulfanylethyl]amino]-N-pyrimidin-2-ylacetamide Traditional Name: 2-[bis[2-[(4-hydroxyphenyl)thio]ethyl]amino]-N-(2-pyrimidyl)acetamide Formula: C22H24N4O3S2 MolecularWeight: 456.58096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NC(=O)CN(CCSC2=CC=C(C=C2)O)CCSC3=CC=C(C=C3)O

Isomeric SMILES

C1=CN=C(N=C1)NC(=O)CN(CCSC2=CC=C(C=C2)O)CCSC3=CC=C(C=C3)O

InChI

InChI=1S/C22H24N4O3S2/c27-17-2-6-19(7-3-17)30-14-12-26(13-15-31-20-8-4-18(28)5-9-20)16-21(29)25-22-23-10-1-11-24-22/h1-11,27-28H,12-16H2,(H,23,24,25,29)