(2S)-2-[4-[(1R)-1-[4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]piperazin-1-ium-1-yl]-N-cyclopropyl-propanamide

Systemtic Name: (2S)-2-[4-[(1R)-1-[4-azanyl-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]piperazin-1-ium-1-yl]-N-cyclopropyl-propanamide Openeye Name: (2S)-2-[4-[(1R)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]piperazin-1-ium-1-yl]-N-cyclopropyl-propanamide CAS Name: (2S)-2-[4-[(1R)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]-1-piperazin-1-iumyl]-N-cyclopropylpropanamide IUPAC Name: (2S)-2-[4-[(1R)-1-[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]ethyl]piperazin-1-ium-1-yl]-N-cyclopropylpropanamide Traditional Name: (2S)-2-[4-[(1R)-1-[4-amino-6-(dimethylamino)-s-triazin-2-yl]ethyl]piperazin-1-ium-1-yl]-N-cyclopropyl-propionamide Formula: C17H31N8O+ MolecularWeight: 363.48104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=NC(=N1)N(C)C)N)N2CC[NH+](CC2)C(C)C(=O)NC3CC3

Isomeric SMILES

C[C@H](C1=NC(=NC(=N1)N(C)C)N)N2CC[NH+](CC2)[C@@H](C)C(=O)NC3CC3

InChI

InChI=1S/C17H30N8O/c1-11(14-20-16(18)22-17(21-14)23(3)4)24-7-9-25(10-8-24)12(2)15(26)19-13-5-6-13/h11-13H,5-10H2,1-4H3,(H,19,26)(H2,18,20,21,22)/p+1/t11-,12+/m1/s1