1-[2-[2-[3-(diethylamino)propoxy]-5-methoxy-phenyl]-2H-1,3-benzothiazol-3-yl]ethanone

Systemtic Name: 1-[2-[2-[3-(diethylamino)propoxy]-5-methoxy-phenyl]-2H-1,3-benzothiazol-3-yl]ethanone Openeye Name: 1-[2-[2-[3-(diethylamino)propoxy]-5-methoxy-phenyl]-2H-1,3-benzothiazol-3-yl]ethanone CAS Name: 1-[2-[2-[3-(diethylamino)propoxy]-5-methoxyphenyl]-2H-1,3-benzothiazol-3-yl]ethanone IUPAC Name: 1-[2-[2-[3-(diethylamino)propoxy]-5-methoxyphenyl]-2H-1,3-benzothiazol-3-yl]ethanone Traditional Name: 1-[2-[2-[3-(diethylamino)propoxy]-5-methoxy-phenyl]-2H-1,3-benzothiazol-3-yl]ethanone Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCOC1=C(C=C(C=C1)OC)C2N(C3=CC=CC=C3S2)C(=O)C

Isomeric SMILES

CCN(CC)CCCOC1=C(C=C(C=C1)OC)C2N(C3=CC=CC=C3S2)C(=O)C

InChI

InChI=1S/C23H30N2O3S/c1-5-24(6-2)14-9-15-28-21-13-12-18(27-4)16-19(21)23-25(17(3)26)20-10-7-8-11-22(20)29-23/h7-8,10-13,16,23H,5-6,9,14-15H2,1-4H3