ethyl N-[2-oxidanylidene-4-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]chromen-7-yl]carbamate

Systemtic Name: ethyl N-[2-oxidanylidene-4-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]chromen-7-yl]carbamate Openeye Name: ethyl N-[2-oxo-4-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]chromen-7-yl]carbamate CAS Name: N-[2-oxo-4-[[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)thio]methyl]-1-benzopyran-7-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-oxo-4-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]chromen-7-yl]carbamate Traditional Name: N-[2-keto-4-[[(5-keto-4-propyl-1H-1,2,4-triazol-3-yl)thio]methyl]chromen-7-yl]carbamic acid ethyl ester Formula: C18H20N4O5S MolecularWeight: 404.4402

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCC2=CC(=O)OC3=C2C=CC(=C3)NC(=O)OCC

Isomeric SMILES

CCCN1C(=O)NN=C1SCC2=CC(=O)OC3=C2C=CC(=C3)NC(=O)OCC

InChI

InChI=1S/C18H20N4O5S/c1-3-7-22-16(24)20-21-17(22)28-10-11-8-15(23)27-14-9-12(5-6-13(11)14)19-18(25)26-4-2/h5-6,8-9H,3-4,7,10H2,1-2H3,(H,19,25)(H,20,24)