8-butoxy-3-methyl-2-(2H-1,2,3,4-tetrazol-5-yl)-5H-thiochromeno[4,3-b]pyran-4-one

Systemtic Name: 8-butoxy-3-methyl-2-(2H-1,2,3,4-tetrazol-5-yl)-5H-thiochromeno[4,3-b]pyran-4-one Openeye Name: 8-butoxy-3-methyl-2-(2H-tetrazol-5-yl)-5H-thiochromeno[4,3-b]pyran-4-one CAS Name: 8-butoxy-3-methyl-2-(2H-tetrazol-5-yl)-5H-thiochromeno[4,3-b]pyran-4-one IUPAC Name: 8-butoxy-3-methyl-2-(2H-tetrazol-5-yl)-5H-thiochromeno[4,3-b]pyran-4-one Traditional Name: 8-butoxy-3-methyl-2-(2H-tetrazol-5-yl)-5H-thiochromeno[4,3-b]pyran-4-one Formula: C18H18N4O3S MolecularWeight: 370.42552

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC2=C(C=C1)C3=C(CS2)C(=O)C(=C(O3)C4=NNN=N4)C

Isomeric SMILES

CCCCOC1=CC2=C(C=C1)C3=C(CS2)C(=O)C(=C(O3)C4=NNN=N4)C

InChI

InChI=1S/C18H18N4O3S/c1-3-4-7-24-11-5-6-12-14(8-11)26-9-13-15(23)10(2)16(25-17(12)13)18-19-21-22-20-18/h5-6,8H,3-4,7,9H2,1-2H3,(H,19,20,21,22)