N-cyclohexyl-2-[(4-morpholin-4-yl-6-phenylazanyl-1,3,5-triazin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-cyclohexyl-2-[(4-morpholin-4-yl-6-phenylazanyl-1,3,5-triazin-2-yl)sulfanyl]ethanamide Openeye Name: 2-[(4-anilino-6-morpholino-1,3,5-triazin-2-yl)sulfanyl]-N-cyclohexyl-acetamide CAS Name: 2-[[4-anilino-6-(4-morpholinyl)-1,3,5-triazin-2-yl]thio]-N-cyclohexylacetamide IUPAC Name: 2-[(4-anilino-6-morpholin-4-yl-1,3,5-triazin-2-yl)sulfanyl]-N-cyclohexylacetamide Traditional Name: 2-[(4-anilino-6-morpholino-s-triazin-2-yl)thio]-N-cyclohexyl-acetamide Formula: C21H28N6O2S MolecularWeight: 428.55102

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CSC2=NC(=NC(=N2)NC3=CC=CC=C3)N4CCOCC4

Isomeric SMILES

C1CCC(CC1)NC(=O)CSC2=NC(=NC(=N2)NC3=CC=CC=C3)N4CCOCC4

InChI

InChI=1S/C21H28N6O2S/c28-18(22-16-7-3-1-4-8-16)15-30-21-25-19(23-17-9-5-2-6-10-17)24-20(26-21)27-11-13-29-14-12-27/h2,5-6,9-10,16H,1,3-4,7-8,11-15H2,(H,22,28)(H,23,24,25,26)