5-nitro-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1-benzothiophene-2-carboxamide

Systemtic Name: 5-nitro-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1-benzothiophene-2-carboxamide Openeye Name: 5-nitro-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)benzothiophene-2-carboxamide CAS Name: 5-nitro-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1-benzothiophene-2-carboxamide IUPAC Name: 5-nitro-N-(3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-1-benzothiophene-2-carboxamide Traditional Name: 5-nitro-N-(3-propargyl-1,3-benzothiazol-2-ylidene)benzothiophene-2-carboxamide Formula: C19H11N3O3S2 MolecularWeight: 393.43894

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C2=CC=CC=C2SC1=NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

C#CCN1C2=CC=CC=C2SC1=NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H11N3O3S2/c1-2-9-21-14-5-3-4-6-16(14)27-19(21)20-18(23)17-11-12-10-13(22(24)25)7-8-15(12)26-17/h1,3-8,10-11H,9H2