2-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methylsulfanyl]-N-butyl-ethanamide

Systemtic Name: 2-[(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)methylsulfanyl]-N-butyl-ethanamide Openeye Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanyl]-N-butyl-acetamide CAS Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylthio]-N-butylacetamide IUPAC Name: 2-[(4-amino-6-anilino-1,3,5-triazin-2-yl)methylsulfanyl]-N-butylacetamide Traditional Name: 2-[(4-amino-6-anilino-s-triazin-2-yl)methylthio]-N-butyl-acetamide Formula: C16H22N6OS MolecularWeight: 346.45048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CSCC1=NC(=NC(=N1)NC2=CC=CC=C2)N

Isomeric SMILES

CCCCNC(=O)CSCC1=NC(=NC(=N1)NC2=CC=CC=C2)N

InChI

InChI=1S/C16H22N6OS/c1-2-3-9-18-14(23)11-24-10-13-20-15(17)22-16(21-13)19-12-7-5-4-6-8-12/h4-8H,2-3,9-11H2,1H3,(H,18,23)(H3,17,19,20,21,22)