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

Systemtic Name: N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]-4-(6-nitro-2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide Openeye Name: N-[2-(dimethylamino)-2-(3-thienyl)ethyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide CAS Name: N-[2-(dimethylamino)-2-(3-thiophenyl)ethyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide IUPAC Name: N-[2-(dimethylamino)-2-thiophen-3-ylethyl]-4-(6-nitro-2-oxo-1,3-benzoxazol-3-yl)butanamide Traditional Name: N-[2-(dimethylamino)-2-(3-thienyl)ethyl]-4-(2-keto-6-nitro-1,3-benzoxazol-3-yl)butyramide Formula: C19H22N4O5S MolecularWeight: 418.46678

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)CCCN1C2=C(C=C(C=C2)[N+](=O)[O-])OC1=O)C3=CSC=C3

Isomeric SMILES

CN(C)C(CNC(=O)CCCN1C2=C(C=C(C=C2)[N+](=O)[O-])OC1=O)C3=CSC=C3

InChI

InChI=1S/C19H22N4O5S/c1-21(2)16(13-7-9-29-12-13)11-20-18(24)4-3-8-22-15-6-5-14(23(26)27)10-17(15)28-19(22)25/h5-7,9-10,12,16H,3-4,8,11H2,1-2H3,(H,20,24)