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

Systemtic Name: N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-1-oxidanylidene-6-propan-2-yl-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-6-isopropyl-1-oxo-isochromane-3-carboxamide CAS Name: N-[5-(butylthio)-1,3,4-thiadiazol-2-yl]-1-oxo-6-propan-2-yl-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-1-oxo-6-propan-2-yl-3,4-dihydroisochromene-3-carboxamide Traditional Name: N-[5-(butylthio)-1,3,4-thiadiazol-2-yl]-6-isopropyl-1-keto-isochroman-3-carboxamide Formula: C19H23N3O3S2 MolecularWeight: 405.53422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(S1)NC(=O)C2CC3=C(C=CC(=C3)C(C)C)C(=O)O2

Isomeric SMILES

CCCCSC1=NN=C(S1)NC(=O)C2CC3=C(C=CC(=C3)C(C)C)C(=O)O2

InChI

InChI=1S/C19H23N3O3S2/c1-4-5-8-26-19-22-21-18(27-19)20-16(23)15-10-13-9-12(11(2)3)6-7-14(13)17(24)25-15/h6-7,9,11,15H,4-5,8,10H2,1-3H3,(H,20,21,23)