N-[1-[(3,4-dimethoxyphenyl)methyl]piperidin-4-yl]-1,3-benzothiazol-2-amine

Systemtic Name: N-[1-[(3,4-dimethoxyphenyl)methyl]piperidin-4-yl]-1,3-benzothiazol-2-amine Openeye Name: N-[1-[(3,4-dimethoxyphenyl)methyl]-4-piperidyl]-1,3-benzothiazol-2-amine CAS Name: N-[1-[(3,4-dimethoxyphenyl)methyl]-4-piperidinyl]-1,3-benzothiazol-2-amine IUPAC Name: N-[1-[(3,4-dimethoxyphenyl)methyl]piperidin-4-yl]-1,3-benzothiazol-2-amine Traditional Name: 1,3-benzothiazol-2-yl-(1-veratryl-4-piperidyl)amine Formula: C21H25N3O2S MolecularWeight: 383.5071

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCC(CC2)NC3=NC4=CC=CC=C4S3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCC(CC2)NC3=NC4=CC=CC=C4S3)OC

InChI

InChI=1S/C21H25N3O2S/c1-25-18-8-7-15(13-19(18)26-2)14-24-11-9-16(10-12-24)22-21-23-17-5-3-4-6-20(17)27-21/h3-8,13,16H,9-12,14H2,1-2H3,(H,22,23)