3-azanyl-N-(4-azanylcyclohexyl)-4-(4-morpholin-4-ylcarbonyl-1,4-diazepan-1-yl)benzamide

Systemtic Name: 3-azanyl-N-(4-azanylcyclohexyl)-4-(4-morpholin-4-ylcarbonyl-1,4-diazepan-1-yl)benzamide Openeye Name: 3-amino-N-(4-aminocyclohexyl)-4-[4-(morpholine-4-carbonyl)-1,4-diazepan-1-yl]benzamide CAS Name: 3-amino-N-(4-aminocyclohexyl)-4-[4-[4-morpholinyl(oxo)methyl]-1,4-diazepan-1-yl]benzamide IUPAC Name: 3-amino-N-(4-aminocyclohexyl)-4-[4-(morpholine-4-carbonyl)-1,4-diazepan-1-yl]benzamide Traditional Name: 3-amino-N-(4-aminocyclohexyl)-4-[4-(morpholine-4-carbonyl)-1,4-diazepan-1-yl]benzamide Formula: C23H36N6O3 MolecularWeight: 444.57034

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)N2CCOCC2)C3=C(C=C(C=C3)C(=O)NC4CCC(CC4)N)N

Isomeric SMILES

C1CN(CCN(C1)C(=O)N2CCOCC2)C3=C(C=C(C=C3)C(=O)NC4CCC(CC4)N)N

InChI

InChI=1S/C23H36N6O3/c24-18-3-5-19(6-4-18)26-22(30)17-2-7-21(20(25)16-17)27-8-1-9-28(11-10-27)23(31)29-12-14-32-15-13-29/h2,7,16,18-19H,1,3-6,8-15,24-25H2,(H,26,30)