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

Systemtic Name: N-(2-ethylphenyl)-2-(6-phenylpyrimidin-4-yl)sulfanyl-butanamide Openeye Name: N-(2-ethylphenyl)-2-(6-phenylpyrimidin-4-yl)sulfanyl-butanamide CAS Name: N-(2-ethylphenyl)-2-[(6-phenyl-4-pyrimidinyl)thio]butanamide IUPAC Name: N-(2-ethylphenyl)-2-(6-phenylpyrimidin-4-yl)sulfanylbutanamide Traditional Name: N-(2-ethylphenyl)-2-[(6-phenylpyrimidin-4-yl)thio]butyramide Formula: C22H23N3OS MolecularWeight: 377.50252

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C(CC)SC2=NC=NC(=C2)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C(CC)SC2=NC=NC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H23N3OS/c1-3-16-10-8-9-13-18(16)25-22(26)20(4-2)27-21-14-19(23-15-24-21)17-11-6-5-7-12-17/h5-15,20H,3-4H2,1-2H3,(H,25,26)