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

Systemtic Name: (2R)-N-(1,3-benzothiazol-2-yl)-4-(3-chloranylpyridin-2-yl)-2-methyl-piperazine-1-carboxamide Openeye Name: (2R)-N-(1,3-benzothiazol-2-yl)-4-(3-chloro-2-pyridyl)-2-methyl-piperazine-1-carboxamide CAS Name: (2R)-N-(1,3-benzothiazol-2-yl)-4-(3-chloro-2-pyridinyl)-2-methyl-1-piperazinecarboxamide IUPAC Name: (2R)-N-(1,3-benzothiazol-2-yl)-4-(3-chloropyridin-2-yl)-2-methylpiperazine-1-carboxamide Traditional Name: (2R)-N-(1,3-benzothiazol-2-yl)-4-(3-chloro-2-pyridyl)-2-methyl-piperazine-1-carboxamide Formula: C18H18ClN5OS MolecularWeight: 387.88642

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)NC2=NC3=CC=CC=C3S2)C4=C(C=CC=N4)Cl

Isomeric SMILES

C[C@@H]1CN(CCN1C(=O)NC2=NC3=CC=CC=C3S2)C4=C(C=CC=N4)Cl

InChI

InChI=1S/C18H18ClN5OS/c1-12-11-23(16-13(19)5-4-8-20-16)9-10-24(12)18(25)22-17-21-14-6-2-3-7-15(14)26-17/h2-8,12H,9-11H2,1H3,(H,21,22,25)/t12-/m1/s1