(2Z)-2-(1,3-benzothiazol-2-yl)-2-(5-nitro-2-oxidanylidene-1H-indol-3-ylidene)ethanenitrile

Systemtic Name: (2Z)-2-(1,3-benzothiazol-2-yl)-2-(5-nitro-2-oxidanylidene-1H-indol-3-ylidene)ethanenitrile Openeye Name: (2Z)-2-(1,3-benzothiazol-2-yl)-2-(5-nitro-2-oxo-indolin-3-ylidene)acetonitrile CAS Name: (2Z)-2-(1,3-benzothiazol-2-yl)-2-(5-nitro-2-oxo-1H-indol-3-ylidene)acetonitrile IUPAC Name: (2Z)-2-(1,3-benzothiazol-2-yl)-2-(5-nitro-2-oxo-1H-indol-3-ylidene)acetonitrile Traditional Name: (2Z)-2-(1,3-benzothiazol-2-yl)-2-(2-keto-5-nitro-indolin-3-ylidene)acetonitrile Formula: C17H8N4O3S MolecularWeight: 348.33542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C(=C3C4=C(C=CC(=C4)[N+](=O)[O-])NC3=O)C#N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)/C(=C\3/C4=C(C=CC(=C4)[N+](=O)[O-])NC3=O)/C#N

InChI

InChI=1S/C17H8N4O3S/c18-8-11(17-20-13-3-1-2-4-14(13)25-17)15-10-7-9(21(23)24)5-6-12(10)19-16(15)22/h1-7H,(H,19,22)/b15-11-