4-(1,3-benzothiazol-2-yl)-1-(4-pyrrolidin-1-ylcarbonylpiperidin-1-yl)butan-1-one

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-1-(4-pyrrolidin-1-ylcarbonylpiperidin-1-yl)butan-1-one Openeye Name: 4-(1,3-benzothiazol-2-yl)-1-[4-(pyrrolidine-1-carbonyl)-1-piperidyl]butan-1-one CAS Name: 4-(1,3-benzothiazol-2-yl)-1-[4-[oxo(1-pyrrolidinyl)methyl]-1-piperidinyl]-1-butanone IUPAC Name: 4-(1,3-benzothiazol-2-yl)-1-[4-(pyrrolidine-1-carbonyl)piperidin-1-yl]butan-1-one Traditional Name: 4-(1,3-benzothiazol-2-yl)-1-[4-(pyrrolidine-1-carbonyl)piperidino]butan-1-one Formula: C21H27N3O2S MolecularWeight: 385.52298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2CCN(CC2)C(=O)CCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CCN(C1)C(=O)C2CCN(CC2)C(=O)CCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H27N3O2S/c25-20(9-5-8-19-22-17-6-1-2-7-18(17)27-19)23-14-10-16(11-15-23)21(26)24-12-3-4-13-24/h1-2,6-7,16H,3-5,8-15H2