4-[(1R)-1-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)ethyl]-N,N-diethyl-piperazin-4-ium-1-sulfonamide

Systemtic Name: 4-[(1R)-1-(4-azanyl-6-phenylazanyl-1,3,5-triazin-2-yl)ethyl]-N,N-diethyl-piperazin-4-ium-1-sulfonamide Openeye Name: 4-[(1R)-1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethyl]-N,N-diethyl-piperazin-4-ium-1-sulfonamide CAS Name: 4-[(1R)-1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethyl]-N,N-diethyl-1-piperazin-4-iumsulfonamide IUPAC Name: 4-[(1R)-1-(4-amino-6-anilino-1,3,5-triazin-2-yl)ethyl]-N,N-diethylpiperazin-4-ium-1-sulfonamide Traditional Name: 4-[(1R)-1-(4-amino-6-anilino-s-triazin-2-yl)ethyl]-N,N-diethyl-piperazin-4-ium-1-sulfonamide Formula: C19H31N8O2S+ MolecularWeight: 435.56684

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)N1CC[NH+](CC1)C(C)C2=NC(=NC(=N2)NC3=CC=CC=C3)N

Isomeric SMILES

CCN(CC)S(=O)(=O)N1CC[NH+](CC1)[C@H](C)C2=NC(=NC(=N2)NC3=CC=CC=C3)N

InChI

InChI=1S/C19H30N8O2S/c1-4-26(5-2)30(28,29)27-13-11-25(12-14-27)15(3)17-22-18(20)24-19(23-17)21-16-9-7-6-8-10-16/h6-10,15H,4-5,11-14H2,1-3H3,(H3,20,21,22,23,24)/p+1/t15-/m1/s1