N-(2-azanylcyclohexyl)-3-benzamido-4-(thiomorpholin-4-ylmethyl)benzamide

Systemtic Name: N-(2-azanylcyclohexyl)-3-benzamido-4-(thiomorpholin-4-ylmethyl)benzamide Openeye Name: N-(2-aminocyclohexyl)-3-benzamido-4-(thiomorpholinomethyl)benzamide CAS Name: N-(2-aminocyclohexyl)-3-benzamido-4-(thiomorpholin-4-ylmethyl)benzamide IUPAC Name: N-(2-aminocyclohexyl)-3-benzamido-4-(thiomorpholin-4-ylmethyl)benzamide Traditional Name: N-(2-aminocyclohexyl)-3-benzamido-4-(thiomorpholinomethyl)benzamide Formula: C25H32N4O2S MolecularWeight: 452.61218

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)N)NC(=O)C2=CC(=C(C=C2)CN3CCSCC3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCC(C(C1)N)NC(=O)C2=CC(=C(C=C2)CN3CCSCC3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H32N4O2S/c26-21-8-4-5-9-22(21)27-25(31)19-10-11-20(17-29-12-14-32-15-13-29)23(16-19)28-24(30)18-6-2-1-3-7-18/h1-3,6-7,10-11,16,21-22H,4-5,8-9,12-15,17,26H2,(H,27,31)(H,28,30)