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

Systemtic Name: N-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]benzamide Openeye Name: N-[2-(cyclopropylamino)-2-oxo-ethyl]-4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]benzamide CAS Name: N-[2-(cyclopropylamino)-2-oxoethyl]-4-[[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]amino]benzamide IUPAC Name: N-[2-(cyclopropylamino)-2-oxoethyl]-4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]benzamide Traditional Name: N-[2-(cyclopropylamino)-2-keto-ethyl]-4-[[2-[(1-methylimidazol-2-yl)thio]acetyl]amino]benzamide Formula: C18H21N5O3S MolecularWeight: 387.45604

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)NCC(=O)NC3CC3

Isomeric SMILES

CN1C=CN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)NCC(=O)NC3CC3

InChI

InChI=1S/C18H21N5O3S/c1-23-9-8-19-18(23)27-11-16(25)22-13-4-2-12(3-5-13)17(26)20-10-15(24)21-14-6-7-14/h2-5,8-9,14H,6-7,10-11H2,1H3,(H,20,26)(H,21,24)(H,22,25)