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

Systemtic Name: 2-[1-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)ethylsulfanyl]-N-(4-methoxyphenyl)propanamide Openeye Name: 2-[1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethylsulfanyl]-N-(4-methoxyphenyl)propanamide CAS Name: 2-[1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethylthio]-N-(4-methoxyphenyl)propanamide IUPAC Name: 2-[1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethylsulfanyl]-N-(4-methoxyphenyl)propanamide Traditional Name: 2-[1-(4-amino-6-anilino-s-triazin-2-yl)ethylthio]-N-(4-methoxyphenyl)propionamide Formula: C21H24N6O2S MolecularWeight: 424.51926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NC(=N1)NC2=CC=CC=C2)N)SC(C)C(=O)NC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C1=NC(=NC(=N1)NC2=CC=CC=C2)N)SC(C)C(=O)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H24N6O2S/c1-13(30-14(2)19(28)23-16-9-11-17(29-3)12-10-16)18-25-20(22)27-21(26-18)24-15-7-5-4-6-8-15/h4-14H,1-3H3,(H,23,28)(H3,22,24,25,26,27)