[3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-[(1R)-2-methyl-1-thiophen-2-yl-propyl]azanium

Systemtic Name: [3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-[(1R)-2-methyl-1-thiophen-2-yl-propyl]azanium Openeye Name: [3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxo-propyl]-[(1R)-2-methyl-1-(2-thienyl)propyl]ammonium CAS Name: [3-[4-(4-methoxyphenyl)-1-piperazinyl]-3-oxopropyl]-[(1R)-2-methyl-1-thiophen-2-ylpropyl]ammonium IUPAC Name: [3-[4-(4-methoxyphenyl)piperazin-1-yl]-3-oxopropyl]-[(1R)-2-methyl-1-thiophen-2-ylpropyl]azanium Traditional Name: [3-keto-3-[4-(4-methoxyphenyl)piperazino]propyl]-[(1R)-2-methyl-1-(2-thienyl)propyl]ammonium Formula: C22H32N3O2S+ MolecularWeight: 402.57338

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CS1)[NH2+]CCC(=O)N2CCN(CC2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)[C@H](C1=CC=CS1)[NH2+]CCC(=O)N2CCN(CC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H31N3O2S/c1-17(2)22(20-5-4-16-28-20)23-11-10-21(26)25-14-12-24(13-15-25)18-6-8-19(27-3)9-7-18/h4-9,16-17,22-23H,10-15H2,1-3H3/p+1/t22-/m1/s1