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

Systemtic Name: N-(2-azanylcyclohexyl)-3-(cyclohexylcarbonylamino)-4-(thiomorpholin-4-ylmethyl)benzamide Openeye Name: N-(2-aminocyclohexyl)-3-(cyclohexanecarbonylamino)-4-(thiomorpholinomethyl)benzamide CAS Name: N-(2-aminocyclohexyl)-3-[[cyclohexyl(oxo)methyl]amino]-4-(thiomorpholin-4-ylmethyl)benzamide IUPAC Name: N-(2-aminocyclohexyl)-3-(cyclohexanecarbonylamino)-4-(thiomorpholin-4-ylmethyl)benzamide Traditional Name: N-(2-aminocyclohexyl)-3-(cyclohexanecarbonylamino)-4-(thiomorpholinomethyl)benzamide Formula: C25H38N4O2S MolecularWeight: 458.65982

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=C(C=CC(=C2)C(=O)NC3CCCCC3N)CN4CCSCC4

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=C(C=CC(=C2)C(=O)NC3CCCCC3N)CN4CCSCC4

InChI

InChI=1S/C25H38N4O2S/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/h10-11,16,18,21-22H,1-9,12-15,17,26H2,(H,27,31)(H,28,30)