3-(4-ethylpiperidin-1-yl)-1-[8-[3-(4-ethylpiperidin-1-yl)propanoyl]phenoxathiin-2-yl]propan-1-one

Systemtic Name: 3-(4-ethylpiperidin-1-yl)-1-[8-[3-(4-ethylpiperidin-1-yl)propanoyl]phenoxathiin-2-yl]propan-1-one Openeye Name: 3-(4-ethyl-1-piperidyl)-1-[8-[3-(4-ethyl-1-piperidyl)propanoyl]phenoxathiin-2-yl]propan-1-one CAS Name: 3-(4-ethyl-1-piperidinyl)-1-[8-[3-(4-ethyl-1-piperidinyl)-1-oxopropyl]-2-phenoxathiinyl]-1-propanone IUPAC Name: 3-(4-ethylpiperidin-1-yl)-1-[8-[3-(4-ethylpiperidin-1-yl)propanoyl]phenoxathiin-2-yl]propan-1-one Traditional Name: 3-(4-ethylpiperidino)-1-[8-[3-(4-ethylpiperidino)propanoyl]phenoxathiin-2-yl]propan-1-one Formula: C32H42N2O3S MolecularWeight: 534.75248

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCN(CC1)CCC(=O)C2=CC3=C(C=C2)OC4=C(S3)C=C(C=C4)C(=O)CCN5CCC(CC5)CC

Isomeric SMILES

CCC1CCN(CC1)CCC(=O)C2=CC3=C(C=C2)OC4=C(S3)C=C(C=C4)C(=O)CCN5CCC(CC5)CC

InChI

InChI=1S/C32H42N2O3S/c1-3-23-9-15-33(16-10-23)19-13-27(35)25-5-7-29-31(21-25)38-32-22-26(6-8-30(32)37-29)28(36)14-20-34-17-11-24(4-2)12-18-34/h5-8,21-24H,3-4,9-20H2,1-2H3