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

Systemtic Name: N-[2-chloranyl-5-[4-(4-nitrophenyl)piperazin-1-yl]carbonyl-phenyl]thiophene-2-carboxamide Openeye Name: N-[2-chloro-5-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide CAS Name: N-[2-chloro-5-[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[2-chloro-5-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[2-chloro-5-[4-(4-nitrophenyl)piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide Formula: C22H19ClN4O4S MolecularWeight: 470.92866

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC(=C(C=C3)Cl)NC(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC(=C(C=C3)Cl)NC(=O)C4=CC=CS4

InChI

InChI=1S/C22H19ClN4O4S/c23-18-8-3-15(14-19(18)24-21(28)20-2-1-13-32-20)22(29)26-11-9-25(10-12-26)16-4-6-17(7-5-16)27(30)31/h1-8,13-14H,9-12H2,(H,24,28)