2-(3,4-dimethoxyphenyl)-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)ethanamide

Systemtic Name: 2-(3,4-dimethoxyphenyl)-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)ethanamide Openeye Name: 2-(3,4-dimethoxyphenyl)-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)acetamide CAS Name: 2-(3,4-dimethoxyphenyl)-N-[2-(1-pyrrolidinyl)-1,3-benzothiazol-6-yl]acetamide IUPAC Name: 2-(3,4-dimethoxyphenyl)-N-(2-pyrrolidin-1-yl-1,3-benzothiazol-6-yl)acetamide Traditional Name: 2-(3,4-dimethoxyphenyl)-N-(2-pyrrolidino-1,3-benzothiazol-6-yl)acetamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)NC2=CC3=C(C=C2)N=C(S3)N4CCCC4)OC

InChI

InChI=1S/C21H23N3O3S/c1-26-17-8-5-14(11-18(17)27-2)12-20(25)22-15-6-7-16-19(13-15)28-21(23-16)24-9-3-4-10-24/h5-8,11,13H,3-4,9-10,12H2,1-2H3,(H,22,25)