1-(1,3-benzothiazol-5-yl)-3-[4-(2-cyanopyridin-4-yl)oxy-2-nitro-phenyl]urea

Systemtic Name: 1-(1,3-benzothiazol-5-yl)-3-[4-(2-cyanopyridin-4-yl)oxy-2-nitro-phenyl]urea Openeye Name: 1-(1,3-benzothiazol-5-yl)-3-[4-[(2-cyano-4-pyridyl)oxy]-2-nitro-phenyl]urea CAS Name: 1-(1,3-benzothiazol-5-yl)-3-[4-[(2-cyano-4-pyridinyl)oxy]-2-nitrophenyl]urea IUPAC Name: 1-(1,3-benzothiazol-5-yl)-3-[4-(2-cyanopyridin-4-yl)oxy-2-nitrophenyl]urea Traditional Name: 1-(1,3-benzothiazol-5-yl)-3-[4-[(2-cyano-4-pyridyl)oxy]-2-nitro-phenyl]urea Formula: C20H12N6O4S MolecularWeight: 432.41208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NC(=O)NC3=C(C=C(C=C3)OC4=CC(=NC=C4)C#N)[N+](=O)[O-])N=CS2

Isomeric SMILES

C1=CC2=C(C=C1NC(=O)NC3=C(C=C(C=C3)OC4=CC(=NC=C4)C#N)[N+](=O)[O-])N=CS2

InChI

InChI=1S/C20H12N6O4S/c21-10-13-7-15(5-6-22-13)30-14-2-3-16(18(9-14)26(28)29)25-20(27)24-12-1-4-19-17(8-12)23-11-31-19/h1-9,11H,(H2,24,25,27)