N-(2-ethoxyphenyl)-2-(6-phenylpyrimidin-4-yl)sulfanyl-butanamide

Systemtic Name: N-(2-ethoxyphenyl)-2-(6-phenylpyrimidin-4-yl)sulfanyl-butanamide Openeye Name: N-(2-ethoxyphenyl)-2-(6-phenylpyrimidin-4-yl)sulfanyl-butanamide CAS Name: N-(2-ethoxyphenyl)-2-[(6-phenyl-4-pyrimidinyl)thio]butanamide IUPAC Name: N-(2-ethoxyphenyl)-2-(6-phenylpyrimidin-4-yl)sulfanylbutanamide Traditional Name: N-o-phenetyl-2-[(6-phenylpyrimidin-4-yl)thio]butyramide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1OCC)SC2=NC=NC(=C2)C3=CC=CC=C3

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1OCC)SC2=NC=NC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H23N3O2S/c1-3-20(22(26)25-17-12-8-9-13-19(17)27-4-2)28-21-14-18(23-15-24-21)16-10-6-5-7-11-16/h5-15,20H,3-4H2,1-2H3,(H,25,26)