[(2S)-1-[2-[(4-phenoxyphenyl)amino]-1,3-thiazol-4-yl]propan-2-yl]azanium

Systemtic Name: [(2S)-1-[2-[(4-phenoxyphenyl)amino]-1,3-thiazol-4-yl]propan-2-yl]azanium Openeye Name: [(1S)-1-methyl-2-[2-(4-phenoxyanilino)thiazol-4-yl]ethyl]ammonium CAS Name: [(2S)-1-[2-(4-phenoxyanilino)-4-thiazolyl]propan-2-yl]ammonium IUPAC Name: [(2S)-1-[2-(4-phenoxyanilino)-1,3-thiazol-4-yl]propan-2-yl]azanium Traditional Name: [(1S)-1-methyl-2-[2-(4-phenoxyanilino)thiazol-4-yl]ethyl]ammonium Formula: C18H20N3OS+ MolecularWeight: 326.4359

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CSC(=N1)NC2=CC=C(C=C2)OC3=CC=CC=C3)[NH3+]

Isomeric SMILES

C[C@@H](CC1=CSC(=N1)NC2=CC=C(C=C2)OC3=CC=CC=C3)[NH3+]

InChI

InChI=1S/C18H19N3OS/c1-13(19)11-15-12-23-18(21-15)20-14-7-9-17(10-8-14)22-16-5-3-2-4-6-16/h2-10,12-13H,11,19H2,1H3,(H,20,21)/p+1/t13-/m0/s1