N-[[(2R)-5-methyl-7-pyrazin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-4-thiophen-2-yl-butanamide

Systemtic Name: N-[[(2R)-5-methyl-7-pyrazin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-4-thiophen-2-yl-butanamide Openeye Name: N-[[(2R)-5-methyl-7-pyrazin-2-yl-2,3-dihydrobenzofuran-2-yl]methyl]-4-(2-thienyl)butanamide CAS Name: N-[[(2R)-5-methyl-7-(2-pyrazinyl)-2,3-dihydrobenzofuran-2-yl]methyl]-4-thiophen-2-ylbutanamide IUPAC Name: N-[[(2R)-5-methyl-7-pyrazin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]-4-thiophen-2-ylbutanamide Traditional Name: N-[[(2R)-5-methyl-7-pyrazin-2-yl-coumaran-2-yl]methyl]-4-(2-thienyl)butyramide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C1)C3=NC=CN=C3)OC(C2)CNC(=O)CCCC4=CC=CS4

Isomeric SMILES

CC1=CC2=C(C(=C1)C3=NC=CN=C3)O[C@H](C2)CNC(=O)CCCC4=CC=CS4

InChI

InChI=1S/C22H23N3O2S/c1-15-10-16-12-17(13-25-21(26)6-2-4-18-5-3-9-28-18)27-22(16)19(11-15)20-14-23-7-8-24-20/h3,5,7-11,14,17H,2,4,6,12-13H2,1H3,(H,25,26)/t17-/m1/s1