2-phenyl-5-[[(3S)-3-pyrrolidin-1-ium-1-ylpiperidin-1-yl]methyl]-1,3-thiazole

Systemtic Name: 2-phenyl-5-[[(3S)-3-pyrrolidin-1-ium-1-ylpiperidin-1-yl]methyl]-1,3-thiazole Openeye Name: 2-phenyl-5-[[(3S)-3-pyrrolidin-1-ium-1-yl-1-piperidyl]methyl]thiazole CAS Name: 2-phenyl-5-[[(3S)-3-(1-pyrrolidin-1-iumyl)-1-piperidinyl]methyl]thiazole IUPAC Name: 2-phenyl-5-[[(3S)-3-pyrrolidin-1-ium-1-ylpiperidin-1-yl]methyl]-1,3-thiazole Traditional Name: 2-phenyl-5-[[(3S)-3-pyrrolidin-1-ium-1-ylpiperidino]methyl]thiazole Formula: C19H26N3S+ MolecularWeight: 328.49484

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C2CCCN(C2)CC3=CN=C(S3)C4=CC=CC=C4

Isomeric SMILES

C1CC[NH+](C1)[C@H]2CCCN(C2)CC3=CN=C(S3)C4=CC=CC=C4

InChI

InChI=1S/C19H25N3S/c1-2-7-16(8-3-1)19-20-13-18(23-19)15-21-10-6-9-17(14-21)22-11-4-5-12-22/h1-3,7-8,13,17H,4-6,9-12,14-15H2/p+1/t17-/m0/s1