3-[2-[(3R)-3-piperidin-1-ylpyrrolidin-1-yl]-1,3-benzothiazol-6-yl]pyrimidin-4-one

Systemtic Name: 3-[2-[(3R)-3-piperidin-1-ylpyrrolidin-1-yl]-1,3-benzothiazol-6-yl]pyrimidin-4-one Openeye Name: 3-[2-[(3R)-3-(1-piperidyl)pyrrolidin-1-yl]-1,3-benzothiazol-6-yl]pyrimidin-4-one CAS Name: 3-[2-[(3R)-3-(1-piperidinyl)-1-pyrrolidinyl]-1,3-benzothiazol-6-yl]-4-pyrimidinone IUPAC Name: 3-[2-[(3R)-3-piperidin-1-ylpyrrolidin-1-yl]-1,3-benzothiazol-6-yl]pyrimidin-4-one Traditional Name: 3-[2-[(3R)-3-piperidinopyrrolidino]-1,3-benzothiazol-6-yl]pyrimidin-4-one Formula: C20H23N5OS MolecularWeight: 381.49452

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2CCN(C2)C3=NC4=C(S3)C=C(C=C4)N5C=NC=CC5=O

Isomeric SMILES

C1CCN(CC1)[C@@H]2CCN(C2)C3=NC4=C(S3)C=C(C=C4)N5C=NC=CC5=O

InChI

InChI=1S/C20H23N5OS/c26-19-6-8-21-14-25(19)15-4-5-17-18(12-15)27-20(22-17)24-11-7-16(13-24)23-9-2-1-3-10-23/h4-6,8,12,14,16H,1-3,7,9-11,13H2/t16-/m1/s1