3-[3-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]-1,3-thiazolidin-2-one

Systemtic Name: 3-[3-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]-1,3-thiazolidin-2-one Openeye Name: 3-[3-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]-3-oxo-propyl]thiazolidin-2-one CAS Name: 3-[3-[4-(1-naphthalenylmethyl)-1-piperazin-4-iumyl]-3-oxopropyl]-2-thiazolidinone IUPAC Name: 3-[3-[4-(naphthalen-1-ylmethyl)piperazin-4-ium-1-yl]-3-oxopropyl]-1,3-thiazolidin-2-one Traditional Name: 3-[3-keto-3-[4-(1-naphthylmethyl)piperazin-4-ium-1-yl]propyl]thiazolidin-2-one Formula: C21H26N3O2S+ MolecularWeight: 384.51504

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)C(=O)CCN4CCSC4=O

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC3=CC=CC=C32)C(=O)CCN4CCSC4=O

InChI

InChI=1S/C21H25N3O2S/c25-20(8-9-24-14-15-27-21(24)26)23-12-10-22(11-13-23)16-18-6-3-5-17-4-1-2-7-19(17)18/h1-7H,8-16H2/p+1