4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]-N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]benzamide

Systemtic Name: 4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]-N-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]benzamide Openeye Name: N-[2-(isopropylamino)-2-oxo-ethyl]-4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]benzamide CAS Name: 4-[[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]amino]-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide IUPAC Name: 4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide Traditional Name: N-[2-(isopropylamino)-2-keto-ethyl]-4-[[2-[(1-methylimidazol-2-yl)thio]acetyl]amino]benzamide Formula: C18H23N5O3S MolecularWeight: 389.47192

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N5O3S/c1-12(2)21-15(24)10-20-17(26)13-4-6-14(7-5-13)22-16(25)11-27-18-19-8-9-23(18)3/h4-9,12H,10-11H2,1-3H3,(H,20,26)(H,21,24)(H,22,25)