ethyl 2-(3-oxidanylidenebenzo[f]chromen-2-yl)carbonylimino-3-prop-2-ynyl-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 2-(3-oxidanylidenebenzo[f]chromen-2-yl)carbonylimino-3-prop-2-ynyl-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-(3-oxobenzo[f]chromene-2-carbonyl)imino-3-prop-2-ynyl-1,3-benzothiazole-6-carboxylate CAS Name: 2-[oxo-(3-oxo-2-benzo[f][1]benzopyranyl)methyl]imino-3-prop-2-ynyl-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(3-oxobenzo[f]chromene-2-carbonyl)imino-3-prop-2-ynyl-1,3-benzothiazole-6-carboxylate Traditional Name: 2-(3-ketobenzo[f]chromene-2-carbonyl)imino-3-propargyl-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C27H18N2O5S MolecularWeight: 482.50722

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)C3=CC4=C(C=CC5=CC=CC=C54)OC3=O)S2)CC#C

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N(C(=NC(=O)C3=CC4=C(C=CC5=CC=CC=C54)OC3=O)S2)CC#C

InChI

InChI=1S/C27H18N2O5S/c1-3-13-29-21-11-9-17(25(31)33-4-2)14-23(21)35-27(29)28-24(30)20-15-19-18-8-6-5-7-16(18)10-12-22(19)34-26(20)32/h1,5-12,14-15H,4,13H2,2H3