(2S,5R)-3,6-dimethoxy-2-(2-phenylsulfanylprop-2-enyl)-5-propan-2-yl-2,5-dihydropyrazine

Systemtic Name: (2S,5R)-3,6-dimethoxy-2-(2-phenylsulfanylprop-2-enyl)-5-propan-2-yl-2,5-dihydropyrazine Openeye Name: (2R,5S)-2-isopropyl-3,6-dimethoxy-5-(2-phenylsulfanylallyl)-2,5-dihydropyrazine CAS Name: (2S,5R)-3,6-dimethoxy-2-[2-(phenylthio)prop-2-enyl]-5-propan-2-yl-2,5-dihydropyrazine IUPAC Name: (2S,5R)-3,6-dimethoxy-2-(2-phenylsulfanylprop-2-enyl)-5-propan-2-yl-2,5-dihydropyrazine Traditional Name: (2R,5S)-2-isopropyl-3,6-dimethoxy-5-[2-(phenylthio)allyl]-2,5-dihydropyrazine Formula: C18H24N2O2S MolecularWeight: 332.46036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C(=NC(C(=N1)OC)CC(=C)SC2=CC=CC=C2)OC

Isomeric SMILES

CC(C)[C@@H]1C(=N[C@H](C(=N1)OC)CC(=C)SC2=CC=CC=C2)OC

InChI

InChI=1S/C18H24N2O2S/c1-12(2)16-18(22-5)19-15(17(20-16)21-4)11-13(3)23-14-9-7-6-8-10-14/h6-10,12,15-16H,3,11H2,1-2,4-5H3/t15-,16+/m0/s1