N-(6-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-chromene-2-carboxamide

Systemtic Name: N-(6-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-4-oxidanylidene-chromene-2-carboxamide Openeye Name: N-(6-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-4-oxo-chromene-2-carboxamide CAS Name: N-(6-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-4-oxo-1-benzopyran-2-carboxamide IUPAC Name: N-(6-nitro-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-4-oxochromene-2-carboxamide Traditional Name: 4-keto-N-(6-nitro-3-propargyl-1,3-benzothiazol-2-ylidene)chromene-2-carboxamide Formula: C20H11N3O5S MolecularWeight: 405.38344

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)C3=CC(=O)C4=CC=CC=C4O3

Isomeric SMILES

C#CCN1C2=C(C=C(C=C2)[N+](=O)[O-])SC1=NC(=O)C3=CC(=O)C4=CC=CC=C4O3

InChI

InChI=1S/C20H11N3O5S/c1-2-9-22-14-8-7-12(23(26)27)10-18(14)29-20(22)21-19(25)17-11-15(24)13-5-3-4-6-16(13)28-17/h1,3-8,10-11H,9H2