5-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfanyl]-N-(furan-2-ylmethyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfanyl]-N-(furan-2-ylmethyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methylsulfanyl]-N-(2-furylmethyl)-1,3,4-thiadiazol-2-amine CAS Name: 5-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methylthio]-N-(2-furanylmethyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfanyl]-N-(furan-2-ylmethyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(5-ethoxy-2-methyl-coumaran-6-yl)methylthio]-1,3,4-thiadiazol-2-yl]-(2-furfuryl)amine Formula: C19H21N3O3S2 MolecularWeight: 403.51834

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CSC3=NN=C(S3)NCC4=CC=CO4

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CC(O2)C)CSC3=NN=C(S3)NCC4=CC=CO4

InChI

InChI=1S/C19H21N3O3S2/c1-3-23-16-8-13-7-12(2)25-17(13)9-14(16)11-26-19-22-21-18(27-19)20-10-15-5-4-6-24-15/h4-6,8-9,12H,3,7,10-11H2,1-2H3,(H,20,21)