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

Systemtic Name: N-(6-acetamido-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-oxidanylidene-chromene-3-carboxamide Openeye Name: N-(6-acetamido-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-oxo-chromene-3-carboxamide CAS Name: N-(6-acetamido-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: N-(6-acetamido-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-2-oxochromene-3-carboxamide Traditional Name: N-(6-acetamido-3-propargyl-1,3-benzothiazol-2-ylidene)-2-keto-chromene-3-carboxamide Formula: C22H15N3O4S MolecularWeight: 417.4372

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC4=CC=CC=C4OC3=O)S2)CC#C

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC4=CC=CC=C4OC3=O)S2)CC#C

InChI

InChI=1S/C22H15N3O4S/c1-3-10-25-17-9-8-15(23-13(2)26)12-19(17)30-22(25)24-20(27)16-11-14-6-4-5-7-18(14)29-21(16)28/h1,4-9,11-12H,10H2,2H3,(H,23,26)