1-oxidanylidene-N-(5-pentyl-1,3,4-thiadiazol-2-yl)-3-phenyl-3,4-dihydroisochromene-6-carboxamide

Systemtic Name: 1-oxidanylidene-N-(5-pentyl-1,3,4-thiadiazol-2-yl)-3-phenyl-3,4-dihydroisochromene-6-carboxamide Openeye Name: 1-oxo-N-(5-pentyl-1,3,4-thiadiazol-2-yl)-3-phenyl-isochromane-6-carboxamide CAS Name: 1-oxo-N-(5-pentyl-1,3,4-thiadiazol-2-yl)-3-phenyl-3,4-dihydro-1H-2-benzopyran-6-carboxamide IUPAC Name: 1-oxo-N-(5-pentyl-1,3,4-thiadiazol-2-yl)-3-phenyl-3,4-dihydroisochromene-6-carboxamide Traditional Name: N-(5-amyl-1,3,4-thiadiazol-2-yl)-1-keto-3-phenyl-isochroman-6-carboxamide Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(S1)NC(=O)C2=CC3=C(C=C2)C(=O)OC(C3)C4=CC=CC=C4

Isomeric SMILES

CCCCCC1=NN=C(S1)NC(=O)C2=CC3=C(C=C2)C(=O)OC(C3)C4=CC=CC=C4

InChI

InChI=1S/C23H23N3O3S/c1-2-3-5-10-20-25-26-23(30-20)24-21(27)16-11-12-18-17(13-16)14-19(29-22(18)28)15-8-6-4-7-9-15/h4,6-9,11-13,19H,2-3,5,10,14H2,1H3,(H,24,26,27)