5-[(1-methylimidazol-2-yl)sulfanylmethyl]-N-[2-(2-methylpropanoylamino)ethyl]furan-2-carboxamide

Systemtic Name: 5-[(1-methylimidazol-2-yl)sulfanylmethyl]-N-[2-(2-methylpropanoylamino)ethyl]furan-2-carboxamide Openeye Name: 5-[(1-methylimidazol-2-yl)sulfanylmethyl]-N-[2-(2-methylpropanoylamino)ethyl]furan-2-carboxamide CAS Name: 5-[[(1-methyl-2-imidazolyl)thio]methyl]-N-[2-[(2-methyl-1-oxopropyl)amino]ethyl]-2-furancarboxamide IUPAC Name: 5-[(1-methylimidazol-2-yl)sulfanylmethyl]-N-[2-(2-methylpropanoylamino)ethyl]furan-2-carboxamide Traditional Name: N-[2-(isobutyrylamino)ethyl]-5-[[(1-methylimidazol-2-yl)thio]methyl]-2-furamide Formula: C16H22N4O3S MolecularWeight: 350.43588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NCCNC(=O)C1=CC=C(O1)CSC2=NC=CN2C

Isomeric SMILES

CC(C)C(=O)NCCNC(=O)C1=CC=C(O1)CSC2=NC=CN2C

InChI

InChI=1S/C16H22N4O3S/c1-11(2)14(21)17-6-7-18-15(22)13-5-4-12(23-13)10-24-16-19-8-9-20(16)3/h4-5,8-9,11H,6-7,10H2,1-3H3,(H,17,21)(H,18,22)