N-[2-chloranyl-5-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]carbonyl-phenyl]thiophene-2-carboxamide

Systemtic Name: N-[2-chloranyl-5-[4-(2-phenoxyethyl)piperazin-4-ium-1-yl]carbonyl-phenyl]thiophene-2-carboxamide Openeye Name: N-[2-chloro-5-[4-(2-phenoxyethyl)piperazin-4-ium-1-carbonyl]phenyl]thiophene-2-carboxamide CAS Name: N-[2-chloro-5-[oxo-[4-(2-phenoxyethyl)-1-piperazin-4-iumyl]methyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[2-chloro-5-[4-(2-phenoxyethyl)piperazin-4-ium-1-carbonyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[2-chloro-5-[4-(2-phenoxyethyl)piperazin-4-ium-1-carbonyl]phenyl]thiophene-2-carboxamide Formula: C24H25ClN3O3S+ MolecularWeight: 470.9916

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCOC2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)Cl)NC(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CC[NH+]1CCOC2=CC=CC=C2)C(=O)C3=CC(=C(C=C3)Cl)NC(=O)C4=CC=CS4

InChI

InChI=1S/C24H24ClN3O3S/c25-20-9-8-18(17-21(20)26-23(29)22-7-4-16-32-22)24(30)28-12-10-27(11-13-28)14-15-31-19-5-2-1-3-6-19/h1-9,16-17H,10-15H2,(H,26,29)/p+1