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

Systemtic Name: 2-[1-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)ethylsulfanyl]-N-cycloheptyl-propanamide Openeye Name: 2-[1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethylsulfanyl]-N-cycloheptyl-propanamide CAS Name: 2-[1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethylthio]-N-cycloheptylpropanamide IUPAC Name: 2-[1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethylsulfanyl]-N-cycloheptylpropanamide Traditional Name: 2-[1-(4-amino-6-anilino-s-triazin-2-yl)ethylthio]-N-cycloheptyl-propionamide Formula: C21H30N6OS MolecularWeight: 414.5675

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NC(=N1)NC2=CC=CC=C2)N)SC(C)C(=O)NC3CCCCCC3

Isomeric SMILES

CC(C1=NC(=NC(=N1)NC2=CC=CC=C2)N)SC(C)C(=O)NC3CCCCCC3

InChI

InChI=1S/C21H30N6OS/c1-14(29-15(2)19(28)23-16-10-6-3-4-7-11-16)18-25-20(22)27-21(26-18)24-17-12-8-5-9-13-17/h5,8-9,12-16H,3-4,6-7,10-11H2,1-2H3,(H,23,28)(H3,22,24,25,26,27)