6-[2-adamantylidene(methoxy)methyl]-4-methoxy-2-(4-phenylmethoxyphenyl)-1,3-benzothiazole

Systemtic Name: 6-[2-adamantylidene(methoxy)methyl]-4-methoxy-2-(4-phenylmethoxyphenyl)-1,3-benzothiazole Openeye Name: 6-[2-adamantylidene(methoxy)methyl]-2-(4-benzyloxyphenyl)-4-methoxy-1,3-benzothiazole CAS Name: 6-[2-adamantylidene(methoxy)methyl]-4-methoxy-2-(4-phenylmethoxyphenyl)-1,3-benzothiazole IUPAC Name: 6-[2-adamantylidene(methoxy)methyl]-4-methoxy-2-(4-phenylmethoxyphenyl)-1,3-benzothiazole Traditional Name: 6-[2-adamantylidene(methoxy)methyl]-2-(4-benzoxyphenyl)-4-methoxy-1,3-benzothiazole Formula: C33H33NO3S MolecularWeight: 523.68502

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1)C(=C3C4CC5CC(C4)CC3C5)OC)SC(=N2)C6=CC=C(C=C6)OCC7=CC=CC=C7

Isomeric SMILES

COC1=C2C(=CC(=C1)C(=C3C4CC5CC(C4)CC3C5)OC)SC(=N2)C6=CC=C(C=C6)OCC7=CC=CC=C7

InChI

InChI=1S/C33H33NO3S/c1-35-28-17-26(32(36-2)30-24-13-21-12-22(15-24)16-25(30)14-21)18-29-31(28)34-33(38-29)23-8-10-27(11-9-23)37-19-20-6-4-3-5-7-20/h3-11,17-18,21-22,24-25H,12-16,19H2,1-2H3