3-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methylsulfanyl]-5-(2-methylfuran-3-yl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methylsulfanyl]-5-(2-methylfuran-3-yl)-1,2,4-triazol-4-amine Openeye Name: 3-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methylsulfanyl]-5-(2-methyl-3-furyl)-1,2,4-triazol-4-amine CAS Name: 3-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methylthio]-5-(2-methyl-3-furanyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methylsulfanyl]-5-(2-methylfuran-3-yl)-1,2,4-triazol-4-amine Traditional Name: [3-[[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]methylthio]-5-(2-methyl-3-furyl)-1,2,4-triazol-4-yl]amine Formula: C19H22N4O3S MolecularWeight: 386.46798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CSC3=NN=C(N3N)C4=C(OC=C4)C

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C[C@@H](O2)C)CSC3=NN=C(N3N)C4=C(OC=C4)C

InChI

InChI=1S/C19H22N4O3S/c1-4-24-16-8-13-7-11(2)26-17(13)9-14(16)10-27-19-22-21-18(23(19)20)15-5-6-25-12(15)3/h5-6,8-9,11H,4,7,10,20H2,1-3H3/t11-/m0/s1