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

Systemtic Name: 3-methyl-1-oxidanylidene-6-propan-2-yl-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)-4H-isochromene-3-carboxamide Openeye Name: 6-isopropyl-3-methyl-1-oxo-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)isochromane-3-carboxamide CAS Name: 3-methyl-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: 3-methyl-1-oxo-6-propan-2-yl-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)-4H-isochromene-3-carboxamide Traditional Name: 6-isopropyl-1-keto-3-methyl-N-[5-(propylthio)-1,3,4-thiadiazol-2-yl]isochroman-3-carboxamide Formula: C19H23N3O3S2 MolecularWeight: 405.53422

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(S1)NC(=O)C2(CC3=C(C=CC(=C3)C(C)C)C(=O)O2)C

Isomeric SMILES

CCCSC1=NN=C(S1)NC(=O)C2(CC3=C(C=CC(=C3)C(C)C)C(=O)O2)C

InChI

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