(2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-4-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]-3-oxidanylidene-butanenitrile

Systemtic Name: (2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-4-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]-3-oxidanylidene-butanenitrile Openeye Name: (2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-4-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]-3-oxo-butanenitrile CAS Name: (2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-4-[(6-nitro-1H-benzimidazol-2-yl)thio]-3-oxobutanenitrile IUPAC Name: (2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-4-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]-3-oxobutanenitrile Traditional Name: (2Z)-2-(3H-1,3-benzothiazol-2-ylidene)-3-keto-4-[(6-nitro-1H-benzimidazol-2-yl)thio]butyronitrile Formula: C18H11N5O3S2 MolecularWeight: 409.44164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C(C#N)C(=O)CSC3=NC4=C(N3)C=C(C=C4)[N+](=O)[O-])S2

Isomeric SMILES

C1=CC=C2C(=C1)N/C(=C(\C#N)/C(=O)CSC3=NC4=C(N3)C=C(C=C4)[N+](=O)[O-])/S2

InChI

InChI=1S/C18H11N5O3S2/c19-8-11(17-20-13-3-1-2-4-16(13)28-17)15(24)9-27-18-21-12-6-5-10(23(25)26)7-14(12)22-18/h1-7,20H,9H2,(H,21,22)/b17-11-