N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-[(4-dimethylaminophenyl)methyl-methyl-amino]-N-methyl-ethanamide

Systemtic Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-[(4-dimethylaminophenyl)methyl-methyl-amino]-N-methyl-ethanamide Openeye Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-[(4-dimethylaminophenyl)methyl-methyl-amino]-N-methyl-acetamide CAS Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-[(4-dimethylaminophenyl)methyl-methylamino]-N-methylacetamide IUPAC Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-[(4-dimethylaminophenyl)methyl-methylamino]-N-methylacetamide Traditional Name: N-[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-2-[[4-(dimethylamino)benzyl]-methyl-amino]-N-methyl-acetamide Formula: C22H28N4OS MolecularWeight: 396.54892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2S1)N(C)C(=O)CN(C)CC3=CC=C(C=C3)N(C)C

Isomeric SMILES

C[C@H](C1=NC2=CC=CC=C2S1)N(C)C(=O)CN(C)CC3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C22H28N4OS/c1-16(22-23-19-8-6-7-9-20(19)28-22)26(5)21(27)15-25(4)14-17-10-12-18(13-11-17)24(2)3/h6-13,16H,14-15H2,1-5H3/t16-/m1/s1