N-(4-azanylcyclohexyl)-4-(4-morpholin-4-ylcarbonylpiperazin-1-yl)-3-(2-phenylethanoylamino)benzamide

Systemtic Name: N-(4-azanylcyclohexyl)-4-(4-morpholin-4-ylcarbonylpiperazin-1-yl)-3-(2-phenylethanoylamino)benzamide Openeye Name: N-(4-aminocyclohexyl)-4-[4-(morpholine-4-carbonyl)piperazin-1-yl]-3-[(2-phenylacetyl)amino]benzamide CAS Name: N-(4-aminocyclohexyl)-4-[4-[4-morpholinyl(oxo)methyl]-1-piperazinyl]-3-[(1-oxo-2-phenylethyl)amino]benzamide IUPAC Name: N-(4-aminocyclohexyl)-4-[4-(morpholine-4-carbonyl)piperazin-1-yl]-3-[(2-phenylacetyl)amino]benzamide Traditional Name: N-(4-aminocyclohexyl)-4-[4-(morpholine-4-carbonyl)piperazino]-3-[(2-phenylacetyl)amino]benzamide Formula: C30H40N6O4 MolecularWeight: 548.6764

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)N4CCOCC4)NC(=O)CC5=CC=CC=C5

Isomeric SMILES

C1CC(CCC1N)NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)N4CCOCC4)NC(=O)CC5=CC=CC=C5

InChI

InChI=1S/C30H40N6O4/c31-24-7-9-25(10-8-24)32-29(38)23-6-11-27(26(21-23)33-28(37)20-22-4-2-1-3-5-22)34-12-14-35(15-13-34)30(39)36-16-18-40-19-17-36/h1-6,11,21,24-25H,7-10,12-20,31H2,(H,32,38)(H,33,37)