N-[6-[2-(2-nitrophenoxy)ethanoylamino]-1,3-benzothiazol-2-yl]butanamide

Systemtic Name: N-[6-[2-(2-nitrophenoxy)ethanoylamino]-1,3-benzothiazol-2-yl]butanamide Openeye Name: N-[6-[[2-(2-nitrophenoxy)acetyl]amino]-1,3-benzothiazol-2-yl]butanamide CAS Name: N-[6-[[2-(2-nitrophenoxy)-1-oxoethyl]amino]-1,3-benzothiazol-2-yl]butanamide IUPAC Name: N-[6-[[2-(2-nitrophenoxy)acetyl]amino]-1,3-benzothiazol-2-yl]butanamide Traditional Name: N-[6-[[2-(2-nitrophenoxy)acetyl]amino]-1,3-benzothiazol-2-yl]butyramide Formula: C19H18N4O5S MolecularWeight: 414.43502

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)COC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O5S/c1-2-5-17(24)22-19-21-13-9-8-12(10-16(13)29-19)20-18(25)11-28-15-7-4-3-6-14(15)23(26)27/h3-4,6-10H,2,5,11H2,1H3,(H,20,25)(H,21,22,24)