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

Systemtic Name: 2-methyl-3-[2-[(3R)-3-piperidin-1-ylpyrrolidin-1-yl]-1,3-benzothiazol-6-yl]quinazolin-4-one Openeye Name: 2-methyl-3-[2-[(3R)-3-(1-piperidyl)pyrrolidin-1-yl]-1,3-benzothiazol-6-yl]quinazolin-4-one CAS Name: 2-methyl-3-[2-[(3R)-3-(1-piperidinyl)-1-pyrrolidinyl]-1,3-benzothiazol-6-yl]-4-quinazolinone IUPAC Name: 2-methyl-3-[2-[(3R)-3-piperidin-1-ylpyrrolidin-1-yl]-1,3-benzothiazol-6-yl]quinazolin-4-one Traditional Name: 2-methyl-3-[2-[(3R)-3-piperidinopyrrolidino]-1,3-benzothiazol-6-yl]quinazolin-4-one Formula: C25H27N5OS MolecularWeight: 445.57978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H27N5OS/c1-17-26-21-8-4-3-7-20(21)24(31)30(17)18-9-10-22-23(15-18)32-25(27-22)29-14-11-19(16-29)28-12-5-2-6-13-28/h3-4,7-10,15,19H,2,5-6,11-14,16H2,1H3/t19-/m1/s1