furan-2-yl-[4-[1-(2-methyl-3,4-dihydro-2H-thiochromen-6-yl)-1-oxidanyl-propan-2-yl]piperazin-1-yl]methanone

Systemtic Name: furan-2-yl-[4-[1-(2-methyl-3,4-dihydro-2H-thiochromen-6-yl)-1-oxidanyl-propan-2-yl]piperazin-1-yl]methanone Openeye Name: 2-furyl-[4-[2-hydroxy-1-methyl-2-(2-methylthiochroman-6-yl)ethyl]piperazin-1-yl]methanone CAS Name: 2-furanyl-[4-[1-hydroxy-1-(2-methyl-3,4-dihydro-2H-1-benzothiopyran-6-yl)propan-2-yl]-1-piperazinyl]methanone IUPAC Name: furan-2-yl-[4-[1-hydroxy-1-(2-methyl-3,4-dihydro-2H-thiochromen-6-yl)propan-2-yl]piperazin-1-yl]methanone Traditional Name: 2-furyl-[4-[2-hydroxy-1-methyl-2-(2-methylthiochroman-6-yl)ethyl]piperazino]methanone Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(S1)C=CC(=C2)C(C(C)N3CCN(CC3)C(=O)C4=CC=CO4)O

Isomeric SMILES

CC1CCC2=C(S1)C=CC(=C2)C(C(C)N3CCN(CC3)C(=O)C4=CC=CO4)O

InChI

InChI=1S/C22H28N2O3S/c1-15-5-6-17-14-18(7-8-20(17)28-15)21(25)16(2)23-9-11-24(12-10-23)22(26)19-4-3-13-27-19/h3-4,7-8,13-16,21,25H,5-6,9-12H2,1-2H3