methanesulfonic acid; 2-[4-(3,3,3-triphenylpropyl)piperazin-1-yl]-1,3-thiazole

Systemtic Name: methanesulfonic acid; 2-[4-(3,3,3-triphenylpropyl)piperazin-1-yl]-1,3-thiazole Openeye Name: methanesulfonic acid; 2-[4-(3,3,3-triphenylpropyl)piperazin-1-yl]thiazole CAS Name: methanesulfonic acid; 2-[4-(3,3,3-triphenylpropyl)-1-piperazinyl]thiazole IUPAC Name: methanesulfonic acid; 2-[4-(3,3,3-triphenylpropyl)piperazin-1-yl]-1,3-thiazole Traditional Name: mesylic acid; 2-[4-(3,3,3-triphenylpropyl)piperazino]thiazole Formula: C30H37N3O6S3 MolecularWeight: 631.82628

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)O.CS(=O)(=O)O.C1CN(CCN1CCC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=NC=CS5

Isomeric SMILES

CS(=O)(=O)O.CS(=O)(=O)O.C1CN(CCN1CCC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C5=NC=CS5

InChI

InChI=1S/C28H29N3S.2CH4O3S/c1-4-10-24(11-5-1)28(25-12-6-2-7-13-25,26-14-8-3-9-15-26)16-18-30-19-21-31(22-20-30)27-29-17-23-32-27;2*1-5(2,3)4/h1-15,17,23H,16,18-22H2;2*1H3,(H,2,3,4)