2-methyl-3-[2-[(3R)-3-piperidin-1-ylpyrrolidin-1-yl]-1,3-benzothiazol-6-yl]-8-(trifluoromethyl)quinazolin-4-one

Systemtic Name: 2-methyl-3-[2-[(3R)-3-piperidin-1-ylpyrrolidin-1-yl]-1,3-benzothiazol-6-yl]-8-(trifluoromethyl)quinazolin-4-one Openeye Name: 2-methyl-3-[2-[(3R)-3-(1-piperidyl)pyrrolidin-1-yl]-1,3-benzothiazol-6-yl]-8-(trifluoromethyl)quinazolin-4-one CAS Name: 2-methyl-3-[2-[(3R)-3-(1-piperidinyl)-1-pyrrolidinyl]-1,3-benzothiazol-6-yl]-8-(trifluoromethyl)-4-quinazolinone IUPAC Name: 2-methyl-3-[2-[(3R)-3-piperidin-1-ylpyrrolidin-1-yl]-1,3-benzothiazol-6-yl]-8-(trifluoromethyl)quinazolin-4-one Traditional Name: 2-methyl-3-[2-[(3R)-3-piperidinopyrrolidino]-1,3-benzothiazol-6-yl]-8-(trifluoromethyl)quinazolin-4-one Formula: C26H26F3N5OS MolecularWeight: 513.57775

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2C(F)(F)F)C(=O)N1C3=CC4=C(C=C3)N=C(S4)N5CCC(C5)N6CCCCC6

Isomeric SMILES

CC1=NC2=C(C=CC=C2C(F)(F)F)C(=O)N1C3=CC4=C(C=C3)N=C(S4)N5CC[C@H](C5)N6CCCCC6

InChI

InChI=1S/C26H26F3N5OS/c1-16-30-23-19(6-5-7-20(23)26(27,28)29)24(35)34(16)17-8-9-21-22(14-17)36-25(31-21)33-13-10-18(15-33)32-11-3-2-4-12-32/h5-9,14,18H,2-4,10-13,15H2,1H3/t18-/m1/s1