3-[1-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)ethylsulfanyl]-N-(2-chlorophenyl)propanamide

Systemtic Name: 3-[1-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)ethylsulfanyl]-N-(2-chlorophenyl)propanamide Openeye Name: 3-[1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethylsulfanyl]-N-(2-chlorophenyl)propanamide CAS Name: 3-[1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethylthio]-N-(2-chlorophenyl)propanamide IUPAC Name: 3-[1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethylsulfanyl]-N-(2-chlorophenyl)propanamide Traditional Name: 3-[1-(4-amino-6-anilino-s-triazin-2-yl)ethylthio]-N-(2-chlorophenyl)propionamide Formula: C20H21ClN6OS MolecularWeight: 428.93834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NC(=N1)NC2=CC=CC=C2)N)SCCC(=O)NC3=CC=CC=C3Cl

Isomeric SMILES

CC(C1=NC(=NC(=N1)NC2=CC=CC=C2)N)SCCC(=O)NC3=CC=CC=C3Cl

InChI

InChI=1S/C20H21ClN6OS/c1-13(29-12-11-17(28)24-16-10-6-5-9-15(16)21)18-25-19(22)27-20(26-18)23-14-7-3-2-4-8-14/h2-10,13H,11-12H2,1H3,(H,24,28)(H3,22,23,25,26,27)