[2-[2-[7-(1,3-benzothiazol-2-yl)heptyl-methyl-amino]ethyl]-6-fluoranyl-1-propan-2-yl-3,4-dihydro-1H-naphthalen-2-yl] 2-methoxyethanoate

Systemtic Name: [2-[2-[7-(1,3-benzothiazol-2-yl)heptyl-methyl-amino]ethyl]-6-fluoranyl-1-propan-2-yl-3,4-dihydro-1H-naphthalen-2-yl] 2-methoxyethanoate Openeye Name: [2-[2-[7-(1,3-benzothiazol-2-yl)heptyl-methyl-amino]ethyl]-6-fluoro-1-isopropyl-tetralin-2-yl] 2-methoxyacetate CAS Name: 2-methoxyacetic acid [2-[2-[7-(1,3-benzothiazol-2-yl)heptyl-methylamino]ethyl]-6-fluoro-1-propan-2-yl-3,4-dihydro-1H-naphthalen-2-yl] ester IUPAC Name: [2-[2-[7-(1,3-benzothiazol-2-yl)heptyl-methylamino]ethyl]-6-fluoro-1-propan-2-yl-3,4-dihydro-1H-naphthalen-2-yl] 2-methoxyacetate Traditional Name: 2-methoxyacetic acid [2-[2-[7-(1,3-benzothiazol-2-yl)heptyl-methyl-amino]ethyl]-6-fluoro-1-isopropyl-tetralin-2-yl] ester Formula: C33H45FN2O3S MolecularWeight: 568.785403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C2=C(CCC1(CCN(C)CCCCCCCC3=NC4=CC=CC=C4S3)OC(=O)COC)C=C(C=C2)F

Isomeric SMILES

CC(C)C1C2=C(CCC1(CCN(C)CCCCCCCC3=NC4=CC=CC=C4S3)OC(=O)COC)C=C(C=C2)F

InChI

InChI=1S/C33H45FN2O3S/c1-24(2)32-27-16-15-26(34)22-25(27)17-18-33(32,39-31(37)23-38-4)19-21-36(3)20-11-7-5-6-8-14-30-35-28-12-9-10-13-29(28)40-30/h9-10,12-13,15-16,22,24,32H,5-8,11,14,17-21,23H2,1-4H3