4-[(2S)-2-methyl-4-(2-pyrrolidin-1-ium-1-ylethyl)-2,3-dihydro-1,4-benzoxazin-6-yl]-1,3-thiazol-2-amine

Systemtic Name: 4-[(2S)-2-methyl-4-(2-pyrrolidin-1-ium-1-ylethyl)-2,3-dihydro-1,4-benzoxazin-6-yl]-1,3-thiazol-2-amine Openeye Name: 4-[(2S)-2-methyl-4-(2-pyrrolidin-1-ium-1-ylethyl)-2,3-dihydro-1,4-benzoxazin-6-yl]thiazol-2-amine CAS Name: 4-[(2S)-2-methyl-4-[2-(1-pyrrolidin-1-iumyl)ethyl]-2,3-dihydro-1,4-benzoxazin-6-yl]-2-thiazolamine IUPAC Name: 4-[(2S)-2-methyl-4-(2-pyrrolidin-1-ium-1-ylethyl)-2,3-dihydro-1,4-benzoxazin-6-yl]-1,3-thiazol-2-amine Traditional Name: [4-[(2S)-2-methyl-4-(2-pyrrolidin-1-ium-1-ylethyl)-2,3-dihydro-1,4-benzoxazin-6-yl]thiazol-2-yl]amine Formula: C18H25N4OS+ MolecularWeight: 345.4823

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C2=C(O1)C=CC(=C2)C3=CSC(=N3)N)CC[NH+]4CCCC4

Isomeric SMILES

C[C@H]1CN(C2=C(O1)C=CC(=C2)C3=CSC(=N3)N)CC[NH+]4CCCC4

InChI

InChI=1S/C18H24N4OS/c1-13-11-22(9-8-21-6-2-3-7-21)16-10-14(4-5-17(16)23-13)15-12-24-18(19)20-15/h4-5,10,12-13H,2-3,6-9,11H2,1H3,(H2,19,20)/p+1/t13-/m0/s1