N-[cyclopentyl(thiophen-2-yl)methyl]-4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide

Systemtic Name: N-[cyclopentyl(thiophen-2-yl)methyl]-4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide Openeye Name: N-[cyclopentyl(2-thienyl)methyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide CAS Name: N-[cyclopentyl(thiophen-2-yl)methyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide IUPAC Name: N-[cyclopentyl(thiophen-2-yl)methyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide Traditional Name: N-[cyclopentyl(2-thienyl)methyl]-4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)butyramide Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(C2=CC=CS2)NC(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

Isomeric SMILES

C1CCC(C1)C(C2=CC=CS2)NC(=O)CCCN3C4=C(C=C(C=C4)[N+](=O)[O-])OC3=O

InChI

InChI=1S/C21H23N3O5S/c25-19(22-20(14-5-1-2-6-14)18-7-4-12-30-18)8-3-11-23-16-10-9-15(24(27)28)13-17(16)29-21(23)26/h4,7,9-10,12-14,20H,1-3,5-6,8,11H2,(H,22,25)