(4-chloranyl-2-methoxy-5-methyl-phenyl)-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]azanium

Systemtic Name: (4-chloranyl-2-methoxy-5-methyl-phenyl)-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]azanium Openeye Name: (4-chloro-2-methoxy-5-methyl-phenyl)-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]ammonium CAS Name: (4-chloro-2-methoxy-5-methylphenyl)-[2-oxo-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethyl]ammonium IUPAC Name: (4-chloro-2-methoxy-5-methylphenyl)-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]azanium Traditional Name: (4-chloro-2-methoxy-5-methyl-phenyl)-[2-keto-2-[4-(2-thenoyl)piperazino]ethyl]ammonium Formula: C19H23ClN3O3S+ MolecularWeight: 408.92222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)[NH2+]CC(=O)N2CCN(CC2)C(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)[NH2+]CC(=O)N2CCN(CC2)C(=O)C3=CC=CS3

InChI

InChI=1S/C19H22ClN3O3S/c1-13-10-15(16(26-2)11-14(13)20)21-12-18(24)22-5-7-23(8-6-22)19(25)17-4-3-9-27-17/h3-4,9-11,21H,5-8,12H2,1-2H3/p+1