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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)NC(=O)C2(CC3=C(C=CC(=C3)C(C)C)C(=O)O2)C

Isomeric SMILES

CCSC1=NN=C(S1)NC(=O)C2(CC3=C(C=CC(=C3)C(C)C)C(=O)O2)C

InChI

InChI=1S/C18H21N3O3S2/c1-5-25-17-21-20-16(26-17)19-15(23)18(4)9-12-8-11(10(2)3)6-7-13(12)14(22)24-18/h6-8,10H,5,9H2,1-4H3,(H,19,20,23)