6-[3-[(4-methoxyphenyl)methylamino]propyl]-3H-1,3-benzothiazol-2-one

Systemtic Name: 6-[3-[(4-methoxyphenyl)methylamino]propyl]-3H-1,3-benzothiazol-2-one Openeye Name: 6-[3-[(4-methoxyphenyl)methylamino]propyl]-3H-1,3-benzothiazol-2-one CAS Name: 6-[3-[(4-methoxyphenyl)methylamino]propyl]-3H-1,3-benzothiazol-2-one IUPAC Name: 6-[3-[(4-methoxyphenyl)methylamino]propyl]-3H-1,3-benzothiazol-2-one Traditional Name: 6-[3-(p-anisylamino)propyl]-3H-1,3-benzothiazol-2-one Formula: C18H20N2O2S MolecularWeight: 328.4286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNCCCC2=CC3=C(C=C2)NC(=O)S3

Isomeric SMILES

COC1=CC=C(C=C1)CNCCCC2=CC3=C(C=C2)NC(=O)S3

InChI

InChI=1S/C18H20N2O2S/c1-22-15-7-4-14(5-8-15)12-19-10-2-3-13-6-9-16-17(11-13)23-18(21)20-16/h4-9,11,19H,2-3,10,12H2,1H3,(H,20,21)