N,N-diethyl-4-(4-phenylpiperidin-4-yl)-1,3-thiazol-2-amine; 4-methylbenzenesulfonic acid

Systemtic Name: N,N-diethyl-4-(4-phenylpiperidin-4-yl)-1,3-thiazol-2-amine; 4-methylbenzenesulfonic acid Openeye Name: N,N-diethyl-4-(4-phenyl-4-piperidyl)thiazol-2-amine; 4-methylbenzenesulfonic acid CAS Name: N,N-diethyl-4-(4-phenyl-4-piperidinyl)-2-thiazolamine; 4-methylbenzenesulfonic acid IUPAC Name: N,N-diethyl-4-(4-phenylpiperidin-4-yl)-1,3-thiazol-2-amine; 4-methylbenzenesulfonic acid Traditional Name: diethyl-[4-(4-phenyl-4-piperidyl)thiazol-2-yl]amine; tosylic acid Formula: C25H33N3O3S2 MolecularWeight: 487.67782

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC(=CS1)C2(CCNCC2)C3=CC=CC=C3.CC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CCN(CC)C1=NC(=CS1)C2(CCNCC2)C3=CC=CC=C3.CC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C18H25N3S.C7H8O3S/c1-3-21(4-2)17-20-16(14-22-17)18(10-12-19-13-11-18)15-8-6-5-7-9-15;1-6-2-4-7(5-3-6)11(8,9)10/h5-9,14,19H,3-4,10-13H2,1-2H3;2-5H,1H3,(H,8,9,10)