(3S)-N-(1,3-benzothiazol-2-yl)-N-(3-chloranyl-2-methyl-phenyl)-1-pyrimidin-2-yl-piperidine-3-carboxamide

Systemtic Name: (3S)-N-(1,3-benzothiazol-2-yl)-N-(3-chloranyl-2-methyl-phenyl)-1-pyrimidin-2-yl-piperidine-3-carboxamide Openeye Name: (3S)-N-(1,3-benzothiazol-2-yl)-N-(3-chloro-2-methyl-phenyl)-1-pyrimidin-2-yl-piperidine-3-carboxamide CAS Name: (3S)-N-(1,3-benzothiazol-2-yl)-N-(3-chloro-2-methylphenyl)-1-(2-pyrimidinyl)-3-piperidinecarboxamide IUPAC Name: (3S)-N-(1,3-benzothiazol-2-yl)-N-(3-chloro-2-methylphenyl)-1-pyrimidin-2-ylpiperidine-3-carboxamide Traditional Name: (3S)-N-(1,3-benzothiazol-2-yl)-N-(3-chloro-2-methyl-phenyl)-1-(2-pyrimidyl)nipecotamide Formula: C24H22ClN5OS MolecularWeight: 463.98238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N(C2=NC3=CC=CC=C3S2)C(=O)C4CCCN(C4)C5=NC=CC=N5

Isomeric SMILES

CC1=C(C=CC=C1Cl)N(C2=NC3=CC=CC=C3S2)C(=O)[C@H]4CCCN(C4)C5=NC=CC=N5

InChI

InChI=1S/C24H22ClN5OS/c1-16-18(25)8-4-10-20(16)30(24-28-19-9-2-3-11-21(19)32-24)22(31)17-7-5-14-29(15-17)23-26-12-6-13-27-23/h2-4,6,8-13,17H,5,7,14-15H2,1H3/t17-/m0/s1