2-(4-nitrophenoxy)-4-oxidanylidene-pyrimido[2,1-b][1,3]benzothiazole-3-carbonitrile

Systemtic Name: 2-(4-nitrophenoxy)-4-oxidanylidene-pyrimido[2,1-b][1,3]benzothiazole-3-carbonitrile Openeye Name: 2-(4-nitrophenoxy)-4-oxo-pyrimido[2,1-b][1,3]benzothiazole-3-carbonitrile CAS Name: 2-(4-nitrophenoxy)-4-oxo-3-pyrimido[2,1-b][1,3]benzothiazolecarbonitrile IUPAC Name: 2-(4-nitrophenoxy)-4-oxopyrimido[2,1-b][1,3]benzothiazole-3-carbonitrile Traditional Name: 4-keto-2-(4-nitrophenoxy)pyrimido[2,1-b][1,3]benzothiazole-3-carbonitrile Formula: C17H8N4O4S MolecularWeight: 364.33482

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N3C(=O)C(=C(N=C3S2)OC4=CC=C(C=C4)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC=C2C(=C1)N3C(=O)C(=C(N=C3S2)OC4=CC=C(C=C4)[N+](=O)[O-])C#N

InChI

InChI=1S/C17H8N4O4S/c18-9-12-15(25-11-7-5-10(6-8-11)21(23)24)19-17-20(16(12)22)13-3-1-2-4-14(13)26-17/h1-8H