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

Systemtic Name: 1-oxidanylidene-6-propan-2-yl-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)-3,4-dihydroisochromene-3-carboxamide Openeye Name: 6-isopropyl-1-oxo-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)isochromane-3-carboxamide CAS Name: 1-oxo-6-propan-2-yl-N-[5-(propylthio)-1,3,4-thiadiazol-2-yl]-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: 1-oxo-6-propan-2-yl-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)-3,4-dihydroisochromene-3-carboxamide Traditional Name: 6-isopropyl-1-keto-N-[5-(propylthio)-1,3,4-thiadiazol-2-yl]isochroman-3-carboxamide Formula: C18H21N3O3S2 MolecularWeight: 391.50764

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(S1)NC(=O)C2CC3=C(C=CC(=C3)C(C)C)C(=O)O2

Isomeric SMILES

CCCSC1=NN=C(S1)NC(=O)C2CC3=C(C=CC(=C3)C(C)C)C(=O)O2

InChI

InChI=1S/C18H21N3O3S2/c1-4-7-25-18-21-20-17(26-18)19-15(22)14-9-12-8-11(10(2)3)5-6-13(12)16(23)24-14/h5-6,8,10,14H,4,7,9H2,1-3H3,(H,19,20,22)