2-[[4,6-bis(azanyl)-1,3,5-triazin-2-yl]sulfanyl]-N-(4-phenylbutan-2-yl)propanamide

Systemtic Name: 2-[[4,6-bis(azanyl)-1,3,5-triazin-2-yl]sulfanyl]-N-(4-phenylbutan-2-yl)propanamide Openeye Name: 2-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]-N-(1-methyl-3-phenyl-propyl)propanamide CAS Name: 2-[(4,6-diamino-1,3,5-triazin-2-yl)thio]-N-(4-phenylbutan-2-yl)propanamide IUPAC Name: 2-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]-N-(4-phenylbutan-2-yl)propanamide Traditional Name: 2-[(4,6-diamino-s-triazin-2-yl)thio]-N-(1-methyl-3-phenyl-propyl)propionamide Formula: C16H22N6OS MolecularWeight: 346.45048

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)NC(=O)C(C)SC2=NC(=NC(=N2)N)N

Isomeric SMILES

CC(CCC1=CC=CC=C1)NC(=O)C(C)SC2=NC(=NC(=N2)N)N

InChI

InChI=1S/C16H22N6OS/c1-10(8-9-12-6-4-3-5-7-12)19-13(23)11(2)24-16-21-14(17)20-15(18)22-16/h3-7,10-11H,8-9H2,1-2H3,(H,19,23)(H4,17,18,20,21,22)