3-methyl-N-[4-[2-(1-methylimidazol-2-yl)sulfanylethanoyl]phenyl]butanamide

Systemtic Name: 3-methyl-N-[4-[2-(1-methylimidazol-2-yl)sulfanylethanoyl]phenyl]butanamide Openeye Name: 3-methyl-N-[4-[2-(1-methylimidazol-2-yl)sulfanylacetyl]phenyl]butanamide CAS Name: 3-methyl-N-[4-[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]phenyl]butanamide IUPAC Name: 3-methyl-N-[4-[2-(1-methylimidazol-2-yl)sulfanylacetyl]phenyl]butanamide Traditional Name: 3-methyl-N-[4-[2-[(1-methylimidazol-2-yl)thio]acetyl]phenyl]butyramide Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC=CN2C

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)C(=O)CSC2=NC=CN2C

InChI

InChI=1S/C17H21N3O2S/c1-12(2)10-16(22)19-14-6-4-13(5-7-14)15(21)11-23-17-18-8-9-20(17)3/h4-9,12H,10-11H2,1-3H3,(H,19,22)