N-(4-butylphenyl)-2-(6-methylpyrimidin-4-yl)sulfanyl-butanamide

Systemtic Name: N-(4-butylphenyl)-2-(6-methylpyrimidin-4-yl)sulfanyl-butanamide Openeye Name: N-(4-butylphenyl)-2-(6-methylpyrimidin-4-yl)sulfanyl-butanamide CAS Name: N-(4-butylphenyl)-2-[(6-methyl-4-pyrimidinyl)thio]butanamide IUPAC Name: N-(4-butylphenyl)-2-(6-methylpyrimidin-4-yl)sulfanylbutanamide Traditional Name: N-(4-butylphenyl)-2-[(6-methylpyrimidin-4-yl)thio]butyramide Formula: C19H25N3OS MolecularWeight: 343.4863

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C(CC)SC2=NC=NC(=C2)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C(CC)SC2=NC=NC(=C2)C

InChI

InChI=1S/C19H25N3OS/c1-4-6-7-15-8-10-16(11-9-15)22-19(23)17(5-2)24-18-12-14(3)20-13-21-18/h8-13,17H,4-7H2,1-3H3,(H,22,23)