2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-N-(6-nitro-1,3-benzothiazol-2-yl)ethanamide

Systemtic Name: 2-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-N-(6-nitro-1,3-benzothiazol-2-yl)ethanamide Openeye Name: 2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide CAS Name: 2-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide IUPAC Name: 2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide Traditional Name: 2-[4-(2-furoyl)piperazino]-N-(6-nitro-1,3-benzothiazol-2-yl)acetamide Formula: C18H17N5O5S MolecularWeight: 415.42308

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C(=O)C4=CC=CO4

Isomeric SMILES

C1CN(CCN1CC(=O)NC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-])C(=O)C4=CC=CO4

InChI

InChI=1S/C18H17N5O5S/c24-16(20-18-19-13-4-3-12(23(26)27)10-15(13)29-18)11-21-5-7-22(8-6-21)17(25)14-2-1-9-28-14/h1-4,9-10H,5-8,11H2,(H,19,20,24)