2-[1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-methyl-1-oxidanylidene-pentan-2-yl]isoindole-1,3-dione

Systemtic Name: 2-[1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-methyl-1-oxidanylidene-pentan-2-yl]isoindole-1,3-dione Openeye Name: 2-[1-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-3-methyl-butyl]isoindoline-1,3-dione CAS Name: 2-[1-[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]-4-methyl-1-oxopentan-2-yl]isoindole-1,3-dione IUPAC Name: 2-[1-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]-4-methyl-1-oxopentan-2-yl]isoindole-1,3-dione Traditional Name: 2-[1-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-3-methyl-butyl]isoindoline-1,3-quinone Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)N1CCC(CC1)C2=NC3=CC=CC=C3S2)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC(C)CC(C(=O)N1CCC(CC1)C2=NC3=CC=CC=C3S2)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C26H27N3O3S/c1-16(2)15-21(29-24(30)18-7-3-4-8-19(18)25(29)31)26(32)28-13-11-17(12-14-28)23-27-20-9-5-6-10-22(20)33-23/h3-10,16-17,21H,11-15H2,1-2H3