[(S)-(4-methylphenyl)-thiophen-2-yl-methyl]-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]azanium

Systemtic Name: [(S)-(4-methylphenyl)-thiophen-2-yl-methyl]-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]azanium Openeye Name: [2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]-[(S)-p-tolyl(2-thienyl)methyl]ammonium CAS Name: [(S)-(4-methylphenyl)-thiophen-2-ylmethyl]-[2-oxo-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethyl]ammonium IUPAC Name: [(S)-(4-methylphenyl)-thiophen-2-ylmethyl]-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]azanium Traditional Name: [2-keto-2-[4-(2-thenoyl)piperazino]ethyl]-[(S)-p-tolyl(2-thienyl)methyl]ammonium Formula: C23H26N3O2S2+ MolecularWeight: 440.60144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)[NH2+]CC(=O)N3CCN(CC3)C(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H](C2=CC=CS2)[NH2+]CC(=O)N3CCN(CC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C23H25N3O2S2/c1-17-6-8-18(9-7-17)22(19-4-2-14-29-19)24-16-21(27)25-10-12-26(13-11-25)23(28)20-5-3-15-30-20/h2-9,14-15,22,24H,10-13,16H2,1H3/p+1/t22-/m0/s1