4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]-N-[(4-piperidin-1-ylcarbonylphenyl)methyl]benzamide

Systemtic Name: 4-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]-N-[(4-piperidin-1-ylcarbonylphenyl)methyl]benzamide Openeye Name: 4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]benzamide CAS Name: 4-[[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]amino]-N-[[4-[oxo(1-piperidinyl)methyl]phenyl]methyl]benzamide IUPAC Name: 4-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]-N-[[4-(piperidine-1-carbonyl)phenyl]methyl]benzamide Traditional Name: 4-[[2-[(1-methylimidazol-2-yl)thio]acetyl]amino]-N-[4-(piperidine-1-carbonyl)benzyl]benzamide Formula: C26H29N5O3S MolecularWeight: 491.60516

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)NCC3=CC=C(C=C3)C(=O)N4CCCCC4

Isomeric SMILES

CN1C=CN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)NCC3=CC=C(C=C3)C(=O)N4CCCCC4

InChI

InChI=1S/C26H29N5O3S/c1-30-16-13-27-26(30)35-18-23(32)29-22-11-9-20(10-12-22)24(33)28-17-19-5-7-21(8-6-19)25(34)31-14-3-2-4-15-31/h5-13,16H,2-4,14-15,17-18H2,1H3,(H,28,33)(H,29,32)