2-methoxy-4-propan-2-yl-7-[3-(pyridin-2-ylmethyl)-2H-1,3-benzothiazol-2-yl]cyclohepta-2,4,6-trien-1-one

Systemtic Name: 2-methoxy-4-propan-2-yl-7-[3-(pyridin-2-ylmethyl)-2H-1,3-benzothiazol-2-yl]cyclohepta-2,4,6-trien-1-one Openeye Name: 4-isopropyl-2-methoxy-7-[3-(2-pyridylmethyl)-2H-1,3-benzothiazol-2-yl]cyclohepta-2,4,6-trien-1-one CAS Name: 2-methoxy-4-propan-2-yl-7-[3-(2-pyridinylmethyl)-2H-1,3-benzothiazol-2-yl]-1-cyclohepta-2,4,6-trienone IUPAC Name: 2-methoxy-4-propan-2-yl-7-[3-(pyridin-2-ylmethyl)-2H-1,3-benzothiazol-2-yl]cyclohepta-2,4,6-trien-1-one Traditional Name: 4-isopropyl-2-methoxy-7-[3-(2-pyridylmethyl)-2H-1,3-benzothiazol-2-yl]cyclohepta-2,4,6-trien-1-one Formula: C24H24N2O2S MolecularWeight: 404.52456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C(=O)C(=C1)OC)C2N(C3=CC=CC=C3S2)CC4=CC=CC=N4

Isomeric SMILES

CC(C)C1=CC=C(C(=O)C(=C1)OC)C2N(C3=CC=CC=C3S2)CC4=CC=CC=N4

InChI

InChI=1S/C24H24N2O2S/c1-16(2)17-11-12-19(23(27)21(14-17)28-3)24-26(15-18-8-6-7-13-25-18)20-9-4-5-10-22(20)29-24/h4-14,16,24H,15H2,1-3H3