(2R)-4-(3-chloranylpyridin-2-yl)-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-2-methyl-piperazine-1-carboxamide

Systemtic Name: (2R)-4-(3-chloranylpyridin-2-yl)-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-2-methyl-piperazine-1-carboxamide Openeye Name: (2R)-4-(3-chloro-2-pyridyl)-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-2-methyl-piperazine-1-carboxamide CAS Name: (2R)-4-(3-chloro-2-pyridinyl)-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-2-methyl-1-piperazinecarboxamide IUPAC Name: (2R)-4-(3-chloropyridin-2-yl)-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-2-methylpiperazine-1-carboxamide Traditional Name: (2R)-4-(3-chloro-2-pyridyl)-N-(5,6-dimethyl-1,3-benzothiazol-2-yl)-2-methyl-piperazine-1-carboxamide Formula: C20H22ClN5OS MolecularWeight: 415.93958

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)NC2=NC3=C(S2)C=C(C(=C3)C)C)C4=C(C=CC=N4)Cl

Isomeric SMILES

C[C@@H]1CN(CCN1C(=O)NC2=NC3=C(S2)C=C(C(=C3)C)C)C4=C(C=CC=N4)Cl

InChI

InChI=1S/C20H22ClN5OS/c1-12-9-16-17(10-13(12)2)28-19(23-16)24-20(27)26-8-7-25(11-14(26)3)18-15(21)5-4-6-22-18/h4-6,9-10,14H,7-8,11H2,1-3H3,(H,23,24,27)/t14-/m1/s1