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

Systemtic Name: N-methyl-1-[1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-yl]-N-[(2-phenyl-1,3-thiazol-5-yl)methyl]methanamine Openeye Name: N-methyl-1-[1-[(5-methyl-2-furyl)methyl]piperidin-1-ium-4-yl]-N-[(2-phenylthiazol-5-yl)methyl]methanamine CAS Name: N-methyl-1-[1-[(5-methyl-2-furanyl)methyl]-4-piperidin-1-iumyl]-N-[(2-phenyl-5-thiazolyl)methyl]methanamine IUPAC Name: N-methyl-1-[1-[(5-methylfuran-2-yl)methyl]piperidin-1-ium-4-yl]-N-[(2-phenyl-1,3-thiazol-5-yl)methyl]methanamine Traditional Name: methyl-[[1-[(5-methyl-2-furyl)methyl]piperidin-1-ium-4-yl]methyl]-[(2-phenylthiazol-5-yl)methyl]amine Formula: C23H30N3OS+ MolecularWeight: 396.5688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C[NH+]2CCC(CC2)CN(C)CC3=CN=C(S3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(O1)C[NH+]2CCC(CC2)CN(C)CC3=CN=C(S3)C4=CC=CC=C4

InChI

InChI=1S/C23H29N3OS/c1-18-8-9-21(27-18)16-26-12-10-19(11-13-26)15-25(2)17-22-14-24-23(28-22)20-6-4-3-5-7-20/h3-9,14,19H,10-13,15-17H2,1-2H3/p+1