6-(2,6-dimethylpyridin-3-yl)-2-[(3R)-3-piperidin-1-ylpyrrolidin-1-yl]-1,3-benzothiazole

Systemtic Name: 6-(2,6-dimethylpyridin-3-yl)-2-[(3R)-3-piperidin-1-ylpyrrolidin-1-yl]-1,3-benzothiazole Openeye Name: 6-(2,6-dimethyl-3-pyridyl)-2-[(3R)-3-(1-piperidyl)pyrrolidin-1-yl]-1,3-benzothiazole CAS Name: 6-(2,6-dimethyl-3-pyridinyl)-2-[(3R)-3-(1-piperidinyl)-1-pyrrolidinyl]-1,3-benzothiazole IUPAC Name: 6-(2,6-dimethylpyridin-3-yl)-2-[(3R)-3-piperidin-1-ylpyrrolidin-1-yl]-1,3-benzothiazole Traditional Name: 6-(2,6-dimethyl-3-pyridyl)-2-[(3R)-3-piperidinopyrrolidino]-1,3-benzothiazole Formula: C23H28N4S MolecularWeight: 392.56022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)C2=CC3=C(C=C2)N=C(S3)N4CCC(C4)N5CCCCC5)C

Isomeric SMILES

CC1=NC(=C(C=C1)C2=CC3=C(C=C2)N=C(S3)N4CC[C@H](C4)N5CCCCC5)C

InChI

InChI=1S/C23H28N4S/c1-16-6-8-20(17(2)24-16)18-7-9-21-22(14-18)28-23(25-21)27-13-10-19(15-27)26-11-4-3-5-12-26/h6-9,14,19H,3-5,10-13,15H2,1-2H3/t19-/m1/s1