4-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-3-(2-morpholin-4-ium-4-ylethyl)-N-phenyl-1,3-thiazol-2-imine

Systemtic Name: 4-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-3-(2-morpholin-4-ium-4-ylethyl)-N-phenyl-1,3-thiazol-2-imine Openeye Name: 4-[4-[(4-methyl-1-piperidyl)sulfonyl]phenyl]-3-(2-morpholin-4-ium-4-ylethyl)-N-phenyl-thiazol-2-imine CAS Name: 4-[4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]-3-[2-(4-morpholin-4-iumyl)ethyl]-N-phenyl-2-thiazolimine IUPAC Name: 4-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-3-(2-morpholin-4-ium-4-ylethyl)-N-phenyl-1,3-thiazol-2-imine Traditional Name: [4-[4-(4-methylpiperidino)sulfonylphenyl]-3-(2-morpholin-4-ium-4-ylethyl)-4-thiazolin-2-ylidene]-phenyl-amine Formula: C27H35N4O3S2+ MolecularWeight: 527.7218

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=NC4=CC=CC=C4)N3CC[NH+]5CCOCC5

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=CSC(=NC4=CC=CC=C4)N3CC[NH+]5CCOCC5

InChI

InChI=1S/C27H34N4O3S2/c1-22-11-13-30(14-12-22)36(32,33)25-9-7-23(8-10-25)26-21-35-27(28-24-5-3-2-4-6-24)31(26)16-15-29-17-19-34-20-18-29/h2-10,21-22H,11-20H2,1H3/p+1