N-[3-(furan-2-yl)phenyl]-1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-[3-(furan-2-yl)phenyl]-1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-[3-(2-furyl)phenyl]-1-[(2-methylthiazol-5-yl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-[3-(2-furanyl)phenyl]-1-[(2-methyl-5-thiazolyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-[3-(furan-2-yl)phenyl]-1-[(2-methyl-1,3-thiazol-5-yl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-[3-(2-furyl)phenyl]-1-[(2-methylthiazol-5-yl)methyl]piperidin-1-ium-4-carboxamide Formula: C21H24N3O2S+ MolecularWeight: 382.49916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(S1)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC(=C3)C4=CC=CO4

Isomeric SMILES

CC1=NC=C(S1)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC(=C3)C4=CC=CO4

InChI

InChI=1S/C21H23N3O2S/c1-15-22-13-19(27-15)14-24-9-7-16(8-10-24)21(25)23-18-5-2-4-17(12-18)20-6-3-11-26-20/h2-6,11-13,16H,7-10,14H2,1H3,(H,23,25)/p+1