N-(1-adamantylmethyl)-2-[[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-methyl-amino]ethanamide

Systemtic Name: N-(1-adamantylmethyl)-2-[[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-methyl-amino]ethanamide Openeye Name: N-(1-adamantylmethyl)-2-[[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-methyl-amino]acetamide CAS Name: N-(1-adamantylmethyl)-2-[[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-methylamino]acetamide IUPAC Name: N-(1-adamantylmethyl)-2-[[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-methylamino]acetamide Traditional Name: N-(1-adamantylmethyl)-2-[[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-methyl-amino]acetamide Formula: C23H31N3OS MolecularWeight: 397.57674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)N(C)CC(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C[C@H](C1=NC2=CC=CC=C2S1)N(C)CC(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H31N3OS/c1-15(22-25-19-5-3-4-6-20(19)28-22)26(2)13-21(27)24-14-23-10-16-7-17(11-23)9-18(8-16)12-23/h3-6,15-18H,7-14H2,1-2H3,(H,24,27)/t15-,16?,17?,18?,23?/m1/s1