N-[3-chloranyl-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)phenyl]-5-nitro-furan-2-carboxamide

Systemtic Name: N-[3-chloranyl-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)phenyl]-5-nitro-furan-2-carboxamide Openeye Name: N-[3-chloro-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]phenyl]-5-nitro-furan-2-carboxamide CAS Name: N-[3-chloro-4-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]phenyl]-5-nitro-2-furancarboxamide IUPAC Name: N-[3-chloro-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]phenyl]-5-nitrofuran-2-carboxamide Traditional Name: N-[3-chloro-4-[4-(2-thenoyl)piperazino]phenyl]-5-nitro-2-furamide Formula: C20H17ClN4O5S MolecularWeight: 460.89078

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)NC(=O)C3=CC=C(O3)[N+](=O)[O-])Cl)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)NC(=O)C3=CC=C(O3)[N+](=O)[O-])Cl)C(=O)C4=CC=CS4

InChI

InChI=1S/C20H17ClN4O5S/c21-14-12-13(22-19(26)16-5-6-18(30-16)25(28)29)3-4-15(14)23-7-9-24(10-8-23)20(27)17-2-1-11-31-17/h1-6,11-12H,7-10H2,(H,22,26)