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

Systemtic Name: N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-1-oxidanylidene-6-propan-2-yl-3,4-dihydroisochromene-3-carboxamide Openeye Name: N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-6-isopropyl-1-oxo-isochromane-3-carboxamide CAS Name: N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-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)-1-oxo-6-propan-2-yl-3,4-dihydroisochromene-3-carboxamide Traditional Name: N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-6-isopropyl-1-keto-isochroman-3-carboxamide Formula: C17H19N3O3S2 MolecularWeight: 377.48106

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)NC(=O)C2CC3=C(C=CC(=C3)C(C)C)C(=O)O2

Isomeric SMILES

CCSC1=NN=C(S1)NC(=O)C2CC3=C(C=CC(=C3)C(C)C)C(=O)O2

InChI

InChI=1S/C17H19N3O3S2/c1-4-24-17-20-19-16(25-17)18-14(21)13-8-11-7-10(9(2)3)5-6-12(11)15(22)23-13/h5-7,9,13H,4,8H2,1-3H3,(H,18,19,21)