4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]-N-[(1S)-2-morpholin-4-yl-1-phenyl-ethyl]benzamide

Systemtic Name: 4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]-N-[(1S)-2-morpholin-4-yl-1-phenyl-ethyl]benzamide Openeye Name: 4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]-N-[(1S)-2-morpholino-1-phenyl-ethyl]benzamide CAS Name: 4-[[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]amino]-N-[(1S)-2-(4-morpholinyl)-1-phenylethyl]benzamide IUPAC Name: 4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]-N-[(1S)-2-morpholin-4-yl-1-phenylethyl]benzamide Traditional Name: 4-[[2-[(1-methylimidazol-2-yl)thio]acetyl]amino]-N-[(1S)-2-morpholino-1-phenyl-ethyl]benzamide Formula: C25H29N5O3S MolecularWeight: 479.59446

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)NC(CN3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

CN1C=CN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)N[C@H](CN3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C25H29N5O3S/c1-29-12-11-26-25(29)34-18-23(31)27-21-9-7-20(8-10-21)24(32)28-22(19-5-3-2-4-6-19)17-30-13-15-33-16-14-30/h2-12,22H,13-18H2,1H3,(H,27,31)(H,28,32)/t22-/m1/s1